A0A096NHU5_PAPAN Loading...

FYVE, RhoGEF and PH domain containing 2

AlphaFold DB , UniProt , Accession A0A096NHU5, Species PAPAN (Papio anubis, Olive baboon), Gene FGD2, Length 655 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	31.8	Very low	214 Å²	214	119.5 Å²	119.5	100%	1.054	63%	0.626	S	S	*	*				0	-20	0	-139.2	-163.2	-66.8	0	0	112.8
2	K	28.9	Very low	32	Very low	164 Å²	164	117 Å²	117	71%	0.713	62%	0.618	S	S	*	*			trans	-81.4	-43.5	171.1	-78.1	-172.2	170.6	-173.2	0	112.7	A4 S5 E6	K2-A4 VanDerWaalsContact C-N 3.29Å; K2-A4 PolarHBondContact O-N 3.06Å; K2-S5 WeakPolarHBondContact O-CB 3.49Å; K2-S5 PolarHBondContact O-N 3.13Å; K2-S5 PolarHBondContact O-OG 3.49Å; K2-E6 PolarHBondContact O-N 3.08Å
3	E	27.3	Very low	31.8	Very low	137 Å²	137	113.2 Å²	113.2	64%	0.64	61%	0.607	S	S	*	*	H	α-helix	trans	-57.5	-41	-175.6	-57.8	109.7	137	0	0	112.8	S5 E6 E7	E3-S5 PolarHBondContact O-N 3.2Å; E3-E6 PolarHBondContact O-N 2.93Å; E3-E7 PolarHBondContact O-N 2.89Å; E3-E7 VanDerWaalsContact O-N 3.08Å
4	A	31.2	Very low	31.9	Very low	67 Å²	67	112.6 Å²	112.6	55%	0.554	60%	0.604	S	S	*	*	H	α-helix	trans	-66	-7.2	177.3	0	0	0	0	0	115	K2	K2-A4 VanDerWaalsContact C-N 3.29Å; K2-A4 PolarHBondContact O-N 3.06Å
5	S	30.3	Very low	32.3	Very low	61 Å²	61	107.4 Å²	107.4	43%	0.427	58%	0.576	S	S	.	*	H	α-helix	trans	-95.5	-28.4	167.9	66.7	0	0	0	0	112.5	K2 E3 K8 L9	K2-S5 WeakPolarHBondContact O-CB 3.49Å; K2-S5 PolarHBondContact O-N 3.13Å; K2-S5 PolarHBondContact O-OG 3.49Å; E3-S5 PolarHBondContact O-N 3.2Å; S5-K8 PolarHBondContact O-N 3.42Å; S5-L9 PolarHBondContact O-N 2.95Å; S5-L9 VanDerWaalsContact O-N 3.16Å
6	E	28.6	Very low	32.4	Very low	120 Å²	120	105.3 Å²	105.3	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-76.9	-41.4	-179.3	-68.7	163.8	155	0	0	111.1	K2 E3 K8 L9 A10	K2-E6 PolarHBondContact O-N 3.08Å; E3-E6 PolarHBondContact O-N 2.93Å; E6-K8 VanDerWaalsContact C-N 3.28Å; E6-K8 PolarHBondContact O-N 3.41Å; E6-L9 PolarHBondContact O-N 2.66Å; E6-A10 PolarHBondContact O-N 2.83Å
7	E	35.3	Very low	32.3	Very low	150 Å²	150	102.4 Å²	102.4	70%	0.701	55%	0.554	S	S	*	*	H	α-helix	trans	-57.9	-40.2	169.3	-79.5	-170.7	126.8	0	0	112.5	E3 L9 A10 S11	E3-E7 PolarHBondContact O-N 2.89Å; E3-E7 VanDerWaalsContact O-N 3.08Å; E7-L9 VanDerWaalsContact C-N 3.34Å; E7-L9 PolarHBondContact O-N 2.75Å; E7-A10 PolarHBondContact O-N 3Å; E7-S11 PolarHBondContact O-N 3.12Å
8	K	34.4	Very low	32.7	Very low	159 Å²	159	101.1 Å²	101.1	69%	0.691	55%	0.55	S	S	*	.	H	α-helix	trans	-65.6	-37.4	179.6	-113.1	176.6	178.7	176.2	0	112.2	S5 E6 V12	S5-K8 PolarHBondContact O-N 3.42Å; E6-K8 VanDerWaalsContact C-N 3.28Å; E6-K8 PolarHBondContact O-N 3.41Å; K8-V12 WeakPolarHBondContact O-CG2 3.49Å; K8-V12 PolarHBondContact O-N 3.1Å
9	L	29.4	Very low	32.7	Very low	126 Å²	126	100.2 Å²	100.2	66%	0.66	54%	0.54	S	S	*	.	H	α-helix	trans	-71.5	-41.8	174.3	-82.2	159.6	0	0	0	111.7	S5 E6 E7 S11 V12 S13	S5-L9 PolarHBondContact O-N 2.95Å; S5-L9 VanDerWaalsContact O-N 3.16Å; E6-L9 PolarHBondContact O-N 2.66Å; E7-L9 VanDerWaalsContact C-N 3.34Å; E7-L9 PolarHBondContact O-N 2.75Å; L9-S11 PolarHBondContact O-N 3.22Å; L9-V12 PolarHBondContact O-N 3.18Å; L9-S13 VanDerWaalsContact O-CB 3.32Å; L9-S13 WeakPolarHBondContact O-CB 3.29Å; L9-S13 PolarHBondContact O-N 2.78Å
10	A	28.7	Very low	32.7	Very low	50 Å²	50	100.8 Å²	100.8	41%	0.413	54%	0.54	S	S	.	.	H	α-helix	trans	-60.5	-44.6	177	0	0	0	0	0	112.5	E6 E7 V12 S13 N14	E6-A10 PolarHBondContact O-N 2.83Å; E7-A10 PolarHBondContact O-N 3Å; A10-V12 PolarHBondContact O-N 2.98Å; A10-S13 PolarHBondContact O-N 3.07Å; A10-N14 PolarHBondContact O-N 3.15Å
11	S	35.8	Very low	32.7	Very low	67 Å²	67	101.9 Å²	101.9	47%	0.469	55%	0.545	S	S	.	.	H	α-helix	trans	-61.2	-42	178.7	-175.1	0	0	0	0	112.8	E7 L9 L15	E7-S11 PolarHBondContact O-N 3.12Å; L9-S11 PolarHBondContact O-N 3.22Å; S11-L15 PolarHBondContact O-N 3.39Å
12	V	33.5	Very low	32.3	Very low	89 Å²	89	95.6 Å²	95.6	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-72.1	-39.4	177.8	175	0	0	0	0	111.5	K8 L9 A10 N14 L15 V16	K8-V12 WeakPolarHBondContact O-CG2 3.49Å; K8-V12 PolarHBondContact O-N 3.1Å; L9-V12 PolarHBondContact O-N 3.18Å; A10-V12 PolarHBondContact O-N 2.98Å; V12-N14 PolarHBondContact O-N 3.06Å; V12-L15 WeakPolarHBondContact O-CB 3.3Å; V12-L15 PolarHBondContact O-N 2.99Å; V12-V16 PolarHBondContact O-N 3.43Å
13	S	30.3	Very low	32.4	Very low	67 Å²	67	97.3 Å²	97.3	47%	0.469	53%	0.525	S	S	.	.	H	α-helix	trans	-61.6	-41.9	177.4	-168.7	0	0	0	0	112.5	L9 A10 L15 V16 T17	L9-S13 VanDerWaalsContact O-CB 3.32Å; L9-S13 WeakPolarHBondContact O-CB 3.29Å; L9-S13 PolarHBondContact O-N 2.78Å; A10-S13 PolarHBondContact O-N 3.07Å; S13-L15 VanDerWaalsContact C-N 3.34Å; S13-L15 PolarHBondContact O-N 3.45Å; S13-V16 PolarHBondContact O-N 3.06Å; S13-T17 PolarHBondContact O-N 3.3Å; S13-T17 PolarHBondContact O-OG1 2.65Å
14	N	32.1	Very low	32.4	Very low	105 Å²	105	95.1 Å²	95.1	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-36.1	175.9	-72	-6.3	0	0	0	112.2	A10 V12 T17 V18	A10-N14 PolarHBondContact O-N 3.15Å; V12-N14 PolarHBondContact O-N 3.06Å; N14-T17 WeakPolarHBondContact CA-OG1 3.48Å; N14-T17 PolarHBondContact O-OG1 3.49Å; N14-V18 WeakPolarHBondContact O-CG2 3.41Å; N14-V18 PolarHBondContact O-N 3.38Å
15	L	38.6	Very low	32.3	Very low	35 Å²	35	98.1 Å²	98.1	18%	0.183	53%	0.534	C	S	.	.	H	α-helix	trans	-65.3	-42.2	173.4	-88.5	160.8	0	0	0	112.1	S11 V12 S13 F19 F164 F192	S11-L15 PolarHBondContact O-N 3.39Å; V12-L15 WeakPolarHBondContact O-CB 3.3Å; V12-L15 PolarHBondContact O-N 2.99Å; S13-L15 VanDerWaalsContact C-N 3.34Å; S13-L15 PolarHBondContact O-N 3.45Å; L15-F19 WeakPolarHBondContact O-CD2 3.34Å; L15-F19 PolarHBondContact O-N 3.03Å; L15-F164 HydrophobicContact CD1-CE1 4.21Å; L15-F164 HydrophobicContact CD2-CE1 3.93Å; L15-F164 HydrophobicContact CD2-CE2 4.3Å; L15-F164 HydrophobicContact CD2-CZ 3.8Å; L15-F164 HydrophobicContact CG-CE1 4.02Å; L15-F164 HydrophobicContact CG-CZ 4.22Å; L15-F192 HydrophobicContact CD1-CZ 4.32Å; L15-F192 HydrophobicContact CD2-CE1 4.36Å
16	V	33.6	Very low	32.1	Very low	73 Å²	73	104.3 Å²	104.3	44%	0.442	56%	0.557	S	S	.	*	H	α-helix	trans	-64.8	-47.9	177.7	174.5	0	0	0	0	111.2	V12 S13 V18 F19 E20	V12-V16 PolarHBondContact O-N 3.43Å; S13-V16 PolarHBondContact O-N 3.06Å; V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 3.01Å; V16-F19 CarbonylContact O-C 3.58Å; V16-F19 WeakPolarHBondContact O-CA 3.43Å; V16-F19 PolarHBondContact O-N 3.29Å; V16-E20 HydrophobicContact CG1-CG 4.26Å; V16-E20 PolarHBondContact O-N 2.95Å
17	T	31.5	Very low	32.3	Very low	56 Å²	56	103.5 Å²	103.5	34%	0.344	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-32.1	-179.1	39.5	0	0	0	0	113.6	S13 N14 E20 N21	S13-T17 PolarHBondContact O-N 3.3Å; S13-T17 PolarHBondContact O-OG1 2.65Å; N14-T17 WeakPolarHBondContact CA-OG1 3.48Å; N14-T17 PolarHBondContact O-OG1 3.49Å; T17-E20 PolarHBondContact O-N 2.72Å; T17-N21 VanDerWaalsContact O-CB 3.29Å; T17-N21 WeakPolarHBondContact O-CB 3.38Å; T17-N21 PolarHBondContact O-N 2.62Å; T17-N21 PolarHBondContact O-ND2 3.28Å
18	V	39.2	Very low	32	Very low	79 Å²	79	101 Å²	101	48%	0.479	58%	0.576	S	S	.	*	H	α-helix	trans	-67.2	-37.9	170.9	170.7	0	0	0	0	111.9	N14 V16 S22	N14-V18 WeakPolarHBondContact O-CG2 3.41Å; N14-V18 PolarHBondContact O-N 3.38Å; V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 3.01Å; V18-S22 PolarHBondContact O-N 3.08Å; V18-S22 PolarHBondContact O-OG 2.65Å
19	F	33.1	Very low	31.7	Very low	84 Å²	84	99.5 Å²	99.5	37%	0.368	58%	0.582	S	S	.	*	H	α-helix	trans	-73	-23.7	175.2	-94.9	-83.4	0	0	0	114.1	L15 V16 S22 R23	L15-F19 WeakPolarHBondContact O-CD2 3.34Å; L15-F19 PolarHBondContact O-N 3.03Å; V16-F19 CarbonylContact O-C 3.58Å; V16-F19 WeakPolarHBondContact O-CA 3.43Å; V16-F19 PolarHBondContact O-N 3.29Å; F19-S22 WeakPolarHBondContact CA-OG 3.24Å; F19-S22 PolarHBondContact O-OG 2.9Å; F19-R23 WeakPolarHBondContact O-CD 3.27Å; F19-R23 WeakPolarHBondContact O-CG 3.41Å
20	E	32.2	Very low	31.6	Very low	112 Å²	112	105.6 Å²	105.6	52%	0.523	60%	0.597	S	S	.	*	H	α-helix	trans	-84.7	-45.3	175.4	-70.7	-178.3	145.5	0	0	111.8	V16 T17 S22 R23	V16-E20 HydrophobicContact CG1-CG 4.26Å; V16-E20 PolarHBondContact O-N 2.95Å; T17-E20 PolarHBondContact O-N 2.72Å; E20-S22 PolarHBondContact O-N 2.98Å; E20-S22 VanDerWaalsContact O-N 3.1Å; E20-R23 WeakPolarHBondContact O-CB 3.34Å; E20-R23 PolarHBondContact O-N 3.48Å
21	N	31.8	Very low	31.4	Very low	124 Å²	124	106.9 Å²	106.9	66%	0.663	61%	0.614	S	S	*	*	H	α-helix	trans	-64.8	-14.9	177.9	-70	-16.1	0	0	0	113.7	T17	T17-N21 VanDerWaalsContact O-CB 3.29Å; T17-N21 WeakPolarHBondContact O-CB 3.38Å; T17-N21 PolarHBondContact O-N 2.62Å; T17-N21 PolarHBondContact O-ND2 3.28Å
22	S	33	Very low	30.9	Very low	83 Å²	83	112.6 Å²	112.6	58%	0.58	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	0.2	172.4	44.5	0	0	0	0	113.9	V18 F19 E20	V18-S22 PolarHBondContact O-N 3.08Å; V18-S22 PolarHBondContact O-OG 2.65Å; F19-S22 WeakPolarHBondContact CA-OG 3.24Å; F19-S22 PolarHBondContact O-OG 2.9Å; E20-S22 PolarHBondContact O-N 2.98Å; E20-S22 VanDerWaalsContact O-N 3.1Å
23	R	30.3	Very low	30.4	Very low	200 Å²	200	119 Å²	119	76%	0.755	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-14	-178.8	-70.4	177.8	169.4	-178.5	-2.2	115.1	F19 E20	F19-R23 WeakPolarHBondContact O-CD 3.27Å; F19-R23 WeakPolarHBondContact O-CG 3.41Å; E20-R23 WeakPolarHBondContact O-CB 3.34Å; E20-R23 PolarHBondContact O-N 3.48Å
24	T	26.4	Very low	30.1	Very low	91 Å²	91	122 Å²	122	56%	0.558	66%	0.658	S	S	*	*			trans	-117.3	123.5	-174.6	40.7	0	0	0	0	112.5	E26	T24-E26 PolarHBondContact O-N 2.98Å
25	P	29.3	Very low	29.7	Very low	129 Å²	129	125 Å²	125	84%	0.838	67%	0.669	S	S	*	*			trans	-82.8	98.8	170.7	31.7	-31	0	0	0	110.2
26	E	28	Very low	29	Very low	191 Å²	191	130.8 Å²	130.8	89%	0.893	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-66.3	133.9	173	-75.2	-159.5	126.6	0	0	112.1	T24	T24-E26 PolarHBondContact O-N 2.98Å
27	A	31.3	Very low	28.5	Very low	104 Å²	104	130.8 Å²	130.8	86%	0.86	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-100.9	126.8	173.2	0	0	0	0	0	110.4
28	A	28.8	Very low	28.2	Very low	97 Å²	97	136.1 Å²	136.1	80%	0.802	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-102.4	151.6	176.3	0	0	0	0	0	111.9
29	P	28.1	Very low	27.5	Very low	128 Å²	128	141.3 Å²	141.3	83%	0.831	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-88.5	166.5	-158.3	34.5	-37.7	0	0	0	115.8
30	R	27.8	Very low	27	Very low	254 Å²	254	145.7 Å²	145.7	96%	0.958	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-73.8	141.7	172.4	-67.4	-178.2	175.6	-172.9	-1.1	112.2
31	G	25.1	Very low	27	Very low	76 Å²	76	145.9 Å²	145.9	78%	0.784	78%	0.779	S	S	*	*			trans	-144.2	139.9	163.3	0	0	0	0	0	110.8
32	H	24	Very low	26.5	Very low	188 Å²	188	148.1 Å²	148.1	87%	0.87	79%	0.785	S	S	*	*			trans	-93.9	141.7	-179.8	-75.6	-93.9	0	0	0	112.1
33	R	23.2	Very low	25.9	Very low	223 Å²	223	148.8 Å²	148.8	84%	0.842	79%	0.789	S	S	*	*				177.6	137.4	107.1	-97.6	-179.4	177.3	-171.1	-0.7	114.3
34	L	24.1	Very low	25.5	Very low	131 Å²	131	150.3 Å²	150.3	69%	0.686	79%	0.794	S	S	*	*			trans	35.2	129.3	134.5	-58	165.9	0	0	0	121.2
35	E	23.8	Very low	25.7	Very low	168 Å²	168	151.1 Å²	151.1	79%	0.785	80%	0.801	S	S	*	*				19.5	142.3	124.3	-64	152.5	144	0	0	118.3
36	D	24.8	Very low	26.2	Very low	156 Å²	156	150.2 Å²	150.2	83%	0.834	80%	0.795	S	S	*	*			cis	-168.7	177.4	50	-149.7	-17.3	0	0	0	114.8
37	A	23.8	Very low	25.8	Very low	72 Å²	72	153 Å²	153	60%	0.595	80%	0.798	S	S	*	*			trans	67	109.3	149.6	0	0	0	0	0	124
38	H	24.3	Very low	25.6	Very low	169 Å²	169	153.2 Å²	153.2	78%	0.782	79%	0.793	S	S	*	*			trans	36.4	135.5	130.7	-56.2	-72.5	0	0	0	123.9
39	H	23.9	Very low	26	Very low	187 Å²	187	154.6 Å²	154.6	87%	0.866	79%	0.794	S	S	*	*				-171	147.5	104	-99.7	80.2	0	0	0	113.7
40	H	23.5	Very low	25.6	Very low	176 Å²	176	151.7 Å²	151.7	82%	0.815	79%	0.787	S	S	*	*			trans	-122.8	152.8	170.3	-90.3	-60.8	0	0	0	109.9
41	P	31.1	Very low	25.7	Very low	116 Å²	116	145.9 Å²	145.9	75%	0.753	78%	0.782	S	S	*	*				-136.3	-163	92.7	20	3.1	0	0	0	111.1
42	E	22	Very low	25.5	Very low	171 Å²	171	153.3 Å²	153.3	80%	0.799	79%	0.787	S	S	*	*			cis	-145.7	173	-46.6	-103.5	-151.4	81.8	0	0	105.9
43	C	20.1	Very low	25.5	Very low	97 Å²	97	152.7 Å²	152.7	66%	0.655	78%	0.784	S	S	*	*			cis	67.7	141.8	41.4	-66.3	0	0	0	0	115.2
44	R	21.7	Very low	25.5	Very low	232 Å²	232	151.7 Å²	151.7	88%	0.875	79%	0.786	S	S	*	*			cis	-150.3	-173.6	-16	-116	-160.6	174.1	-177.5	-0.5	109.9
45	P	32.2	Very low	25.4	Very low	108 Å²	108	153.6 Å²	153.6	70%	0.701	80%	0.796	S	S	*	*			trans	-112.2	-143.2	-159.1	48	-39.5	0	0	0	112
46	P	38.2	Very low	25.3	Very low	110 Å²	110	153.1 Å²	153.1	71%	0.714	80%	0.799	S	S	*	*			cis	-129.9	-178.3	-28.8	40.2	-25.3	0	0	0	113.4
47	R	21.1	Very low	25.3	Very low	249 Å²	249	153 Å²	153	94%	0.94	80%	0.803	S	S	*	*			trans	-172.8	159.4	142.2	-105.7	161.9	-163.6	-154.6	3.7	114.3
48	S	26.3	Very low	25.2	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	81%	0.808	S	S	*	*			trans	-149.9	-175.7	176.7	61.7	0	0	0	0	107.7
49	P	36.1	Very low	25.2	Very low	126 Å²	126	153.7 Å²	153.7	82%	0.818	81%	0.813	S	S	*	*			cis	-133.9	-176	-2	43.5	-27.2	0	0	0	114.3
50	G	21.1	Very low	25.2	Very low	67 Å²	67	149.8 Å²	149.8	69%	0.691	81%	0.813	S	S	*	*			trans	149	153.6	159.3	0	0	0	0	0	116.6
51	P	29.2	Very low	25.1	Very low	132 Å²	132	150.3 Å²	150.3	86%	0.857	82%	0.818	S	S	*	*				-132.9	141.3	-123.1	38.2	-23.1	0	0	0	118
52	W	22.2	Very low	24.7	Very low	232 Å²	232	148.2 Å²	148.2	88%	0.879	82%	0.817	S	S	*	*			trans	-170	157.6	156.8	68.9	-63.7	0	0	0	107.2
53	E	23.3	Very low	24.7	Very low	174 Å²	174	145.3 Å²	145.3	81%	0.813	82%	0.816	S	S	*	*			cis	-150.2	171.4	-23.1	-117.8	-178.5	146.6	0	0	107.9
54	K	22.2	Very low	24.8	Very low	203 Å²	203	147.1 Å²	147.1	88%	0.883	82%	0.815	S	S	*	*			trans	-81.4	131.4	-176.9	-70.7	179.2	178.6	177.1	0	112.7
55	L	22.3	Very low	24.9	Very low	171 Å²	171	142.1 Å²	142.1	90%	0.895	81%	0.812	S	S	*	*			trans	-134.2	150.4	152.5	-96.3	168.4	0	0	0	110
56	N	21.8	Very low	24.7	Very low	158 Å²	158	148.1 Å²	148.1	85%	0.845	82%	0.821	S	S	*	*			trans	-78	142.4	-161.5	-70.2	-27.7	0	0	0	114
57	V	24.7	Very low	24.1	Very low	152 Å²	152	147.9 Å²	147.9	92%	0.921	82%	0.818	S	S	*	*			trans	-79.9	133	154.6	177.5	0	0	0	0	107.8
58	G	22.8	Very low	24.5	Very low	67 Å²	67	137.9 Å²	137.9	69%	0.691	78%	0.784	S	S	*	*			trans	-154.6	87.5	-178.2	0	0	0	0	0	111.8
59	E	23.6	Very low	24.6	Very low	189 Å²	189	136 Å²	136	88%	0.883	77%	0.771	S	S	*	*			trans	39.7	120.4	157.5	-62.2	178.1	121.8	0	0	119.9	M61	E59-M61 PolarHBondContact O-N 3.44Å
60	A	23.5	Very low	24.4	Very low	106 Å²	106	131.8 Å²	131.8	88%	0.876	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.4	118.6	172.8	0	0	0	0	0	111.4	G62	A60-G62 PolarHBondContact O-N 3.34Å
61	M	22	Very low	24.8	Very low	187 Å²	187	139.1 Å²	139.1	92%	0.921	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-66.2	131.4	165.6	-76	-168.7	74.5	0	0	110.5	E59	E59-M61 PolarHBondContact O-N 3.44Å
62	G	22.1	Very low	25.1	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-62.1	138.2	175.9	0	0	0	0	0	112.4	A60 E64	A60-G62 PolarHBondContact O-N 3.34Å; G62-E64 PolarHBondContact O-N 2.94Å
63	S	22.4	Very low	25.7	Very low	111 Å²	111	127.3 Å²	127.3	78%	0.776	70%	0.698	S	S	*	*			trans	-81.8	103.3	177.5	54.7	0	0	0	0	111.4
64	E	23.1	Very low	25.9	Very low	134 Å²	134	123.6 Å²	123.6	63%	0.626	68%	0.684	S	S	*	*			trans	-59.6	151.7	163.2	-65	-176.2	137.7	0	0	110.8	G62 R66	G62-E64 PolarHBondContact O-N 2.94Å; E64-R66 PolarHBondContact O-N 3.35Å
65	P	23.2	Very low	26.4	Very low	127 Å²	127	116.4 Å²	116.4	83%	0.825	66%	0.659	S	S	*	*			trans	-59.3	113.2	173.7	-21.3	33.1	0	0	0	110.4	T67	P65-T67 PolarHBondContact O-N 3.25Å; P65-T67 VanDerWaalsContact O-N 3.1Å
66	R	26.7	Very low	26.8	Very low	234 Å²	234	110.6 Å²	110.6	88%	0.883	63%	0.629	S	S	*	*			trans	-73.5	104.9	-175.6	-69.1	-176.6	176.7	177.1	-0.1	110.6	E64	E64-R66 PolarHBondContact O-N 3.35Å
67	T	25.5	Very low	27.2	Very low	105 Å²	105	107.6 Å²	107.6	64%	0.644	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-64.3	146.8	168.1	45	0	0	0	0	111.1	P65 D312	P65-T67 PolarHBondContact O-N 3.25Å; P65-T67 VanDerWaalsContact O-N 3.1Å; T67-D312 HydrophobicContact CG2-CB 3.96Å
68	V	30.4	Very low	27.6	Very low	39 Å²	39	104.2 Å²	104.2	24%	0.236	59%	0.585	C	S	.	*	P	Polyproline II helix	trans	-72.4	152.7	-179.6	-179.9	0	0	0	0	109.7	Y72 L236 D311	V68-Y72 HydrophobicContact CG1-CD1 3.96Å; V68-Y72 HydrophobicContact CG1-CG 4.42Å; V68-L236 HydrophobicContact CG2-CD2 3.77Å; V68-D311 HydrophobicContact CB-CB 3.97Å; V68-D311 VanDerWaalsContact CB-OD1 3.24Å; V68-D311 WeakPolarHBondContact CB-OD1 3.39Å; V68-D311 WeakPolarHBondContact CG1-OD1 3.45Å; V68-D311 VanDerWaalsContact O-CB 3.32Å; V68-D311 WeakPolarHBondContact O-CB 3.22Å
69	S	28.8	Very low	28.2	Very low	72 Å²	72	104.3 Å²	104.3	50%	0.503	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-91.8	120.5	-173.9	-170	0	0	0	0	111.8	R71 Y72	S69-R71 PolarHBondContact O-N 3.36Å; S69-Y72 VanDerWaalsContact O-CB 3.28Å; S69-Y72 WeakPolarHBondContact O-CB 3.26Å; S69-Y72 PolarHBondContact O-N 3.12Å
70	G	30.5	Very low	28.6	Very low	37 Å²	37	99 Å²	99	38%	0.381	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	4.8	-179.7	0	0	0	0	0	118.2	Y72 N74 D311	G70-Y72 VanDerWaalsContact C-N 3.25Å; G70-N74 PolarHBondContact O-ND2 3.33Å; G70-D311 WeakPolarHBondContact CA-OD2 3.48Å; G70-D311 PolarHBondContact N-OD2 2.92Å; G70-D311 VanDerWaalsContact N-OD2 3.08Å
71	R	30.4	Very low	29	Very low	220 Å²	220	98.3 Å²	98.3	83%	0.83	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-25.3	156.8	-82.7	-173.1	-85	-171	-5.8	112.2	S69	S69-R71 PolarHBondContact O-N 3.36Å
72	Y	34.6	Very low	29.4	Very low	85 Å²	85	94.1 Å²	94.1	33%	0.333	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-50.9	-178.8	-172.8	-112.5	0	0	0	112.6	V68 S69 G70 N74 S75 L76 R120 L236	V68-Y72 HydrophobicContact CG1-CD1 3.96Å; V68-Y72 HydrophobicContact CG1-CG 4.42Å; S69-Y72 VanDerWaalsContact O-CB 3.28Å; S69-Y72 WeakPolarHBondContact O-CB 3.26Å; S69-Y72 PolarHBondContact O-N 3.12Å; G70-Y72 VanDerWaalsContact C-N 3.25Å; Y72-N74 VanDerWaalsContact C-N 3.28Å; Y72-N74 PolarHBondContact O-N 3.34Å; Y72-S75 WeakPolarHBondContact O-CA 3.48Å; Y72-S75 WeakPolarHBondContact O-CB 3.43Å; Y72-S75 PolarHBondContact O-N 3.18Å; Y72-L76 HydrophobicContact CE1-CD1 4.43Å; Y72-R120 PolarHBondContact OH-NH2 2.86Å; Y72-L236 HydrophobicContact CE1-CD1 4.44Å
73	L	35.3	Very low	29.9	Very low	32 Å²	32	92.8 Å²	92.8	17%	0.168	51%	0.508	C	S	.	.	H	α-helix	trans	-70	-21.3	178.7	-61.4	-175.3	0	0	0	113.9	S75 L76 K77 L309 D311	L73-S75 PolarHBondContact O-N 3.49Å; L73-L76 HydrophobicContact CD2-CD1 3.7Å; L73-L76 PolarHBondContact O-N 3.49Å; L73-K77 PolarHBondContact O-N 2.93Å; L73-L309 HydrophobicContact CD1-CB 4.31Å; L73-L309 VanDerWaalsContact CD1-O 3.24Å; L73-L309 WeakPolarHBondContact CD1-O 3.45Å; L73-D311 HydrophobicContact CD1-CB 4.24Å; L73-D311 VanDerWaalsContact CD1-CG 3.43Å; L73-D311 WeakPolarHBondContact CD1-OD1 3.23Å; L73-D311 WeakPolarHBondContact CG-OD1 3.43Å
74	N	28.9	Very low	30.3	Very low	96 Å²	96	89.1 Å²	89.1	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-60.9	-25.2	164.2	-90	-68.4	0	0	0	112.7	G70 Y72 N78	G70-N74 PolarHBondContact O-ND2 3.33Å; Y72-N74 VanDerWaalsContact C-N 3.28Å; Y72-N74 PolarHBondContact O-N 3.34Å; N74-N78 WeakPolarHBondContact O-CB 3.47Å; N74-N78 PolarHBondContact O-N 3.41Å; N74-N78 PolarHBondContact O-ND2 3.37Å
75	S	31.1	Very low	30.8	Very low	51 Å²	51	85.4 Å²	85.4	36%	0.357	46%	0.464	S	S	.	.	H	α-helix	trans	-69.9	-41.2	169.6	-162.4	0	0	0	0	111.5	Y72 L73 K79	Y72-S75 WeakPolarHBondContact O-CA 3.48Å; Y72-S75 WeakPolarHBondContact O-CB 3.43Å; Y72-S75 PolarHBondContact O-N 3.18Å; L73-S75 PolarHBondContact O-N 3.49Å; S75-K79 WeakPolarHBondContact O-CD 3.37Å; S75-K79 WeakPolarHBondContact O-CG 3.17Å; S75-K79 PolarHBondContact O-N 3.16Å
76	L	30.6	Very low	31.3	Very low	49 Å²	49	88 Å²	88	26%	0.257	46%	0.458	S	S	.	.	H	α-helix	trans	-67.6	-37.8	176	-86.5	111.2	0	0	0	113.2	Y72 L73 K79 L80	Y72-L76 HydrophobicContact CE1-CD1 4.43Å; L73-L76 HydrophobicContact CD2-CD1 3.7Å; L73-L76 PolarHBondContact O-N 3.49Å; L76-K79 WeakPolarHBondContact O-CB 3.48Å; L76-K79 PolarHBondContact O-N 3.36Å; L76-L80 HydrophobicContact CD2-CD1 4.37Å; L76-L80 PolarHBondContact O-N 3.38Å
77	K	31.5	Very low	31.4	Very low	95 Å²	95	86 Å²	86	41%	0.413	46%	0.455	S	S	.	.	H	α-helix	trans	-70.7	-39.2	178.2	-174.4	-179.8	175	-173.5	0	113.5	L73 K79	L73-K77 PolarHBondContact O-N 2.93Å; K77-K79 PolarHBondContact O-N 2.99Å
78	N	33.1	Very low	31.6	Very low	82 Å²	82	85.2 Å²	85.2	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-20.5	173.3	-81.9	-36.9	0	0	0	112.7	N74 A84 W85	N74-N78 WeakPolarHBondContact O-CB 3.47Å; N74-N78 PolarHBondContact O-N 3.41Å; N74-N78 PolarHBondContact O-ND2 3.37Å; N78-A84 HydrophobicContact CB-CB 3.65Å; N78-A84 CarbonylContact O-C 3.13Å; N78-A84 VanDerWaalsContact O-CA 3.27Å; N78-A84 WeakPolarHBondContact O-CA 3.48Å; N78-A84 VanDerWaalsContact O-CB 3.27Å; N78-A84 WeakPolarHBondContact O-CB 3.4Å; N78-A84 PolarHBondContact O-N 3.04Å; N78-W85 PolarHBondContact O-N 2.98Å
79	K	34.1	Very low	31.6	Very low	69 Å²	69	88.5 Å²	88.5	30%	0.3	48%	0.478	S	S	.	.	H	α-helix	trans	-86	-71.7	176.6	-70.7	179	169.6	-163.2	0	110.5	S75 L76 K77 S81 W85	S75-K79 WeakPolarHBondContact O-CD 3.37Å; S75-K79 WeakPolarHBondContact O-CG 3.17Å; S75-K79 PolarHBondContact O-N 3.16Å; L76-K79 WeakPolarHBondContact O-CB 3.48Å; L76-K79 PolarHBondContact O-N 3.36Å; K77-K79 PolarHBondContact O-N 2.99Å; K79-S81 VanDerWaalsContact C-N 3.28Å; K79-S81 PolarHBondContact O-N 3.35Å; K79-W85 HydrophobicContact CB-CD2 3.64Å; K79-W85 HydrophobicContact CB-CE3 3.7Å; K79-W85 HydrophobicContact CB-CG 4.41Å; K79-W85 HydrophobicContact CB-CH2 3.64Å; K79-W85 HydrophobicContact CB-CZ2 3.62Å; K79-W85 HydrophobicContact CB-CZ3 3.69Å; K79-W85 HydrophobicContact CD-CD2 4.31Å; K79-W85 HydrophobicContact CD-CE3 3.55Å; K79-W85 HydrophobicContact CD-CH2 4.19Å; K79-W85 HydrophobicContact CD-CZ3 3.46Å; K79-W85 VanDerWaalsContact CD-CZ3 3.46Å; K79-W85 HydrophobicContact CG-CD2 3.56Å; K79-W85 HydrophobicContact CG-CE3 3.31Å; K79-W85 HydrophobicContact CG-CG 4.21Å; K79-W85 HydrophobicContact CG-CH2 4.12Å; K79-W85 HydrophobicContact CG-CZ2 4.37Å; K79-W85 HydrophobicContact CG-CZ3 3.61Å; K79-W85 PolarHBondContact O-NE1 3.28Å
80	L	33.4	Very low	31.4	Very low	78 Å²	78	94.5 Å²	94.5	41%	0.408	50%	0.498	S	S	.	.	H	α-helix	trans	-69.8	9.6	-163.5	-73.8	165.3	0	0	0	118.6	L76 W301	L76-L80 HydrophobicContact CD2-CD1 4.37Å; L76-L80 PolarHBondContact O-N 3.38Å; L80-W301 HydrophobicContact CD1-CH2 4.5Å; L80-W301 HydrophobicContact CD1-CZ2 3.87Å
81	S	31.9	Very low	31.4	Very low	90 Å²	90	98.2 Å²	98.2	63%	0.629	52%	0.515	S	S	*	.	S	Bend	trans	-143	-37.4	-172.9	-169.3	0	0	0	0	117.3	K79	K79-S81 VanDerWaalsContact C-N 3.28Å; K79-S81 PolarHBondContact O-N 3.35Å
82	S	30.7	Very low	31.6	Very low	100 Å²	100	94.2 Å²	94.2	70%	0.699	52%	0.515	S	S	*	.	S	Bend	trans	-167.1	119.7	168.1	-168.8	0	0	0	0	113.7	A84	S82-A84 PolarHBondContact O-N 3.47Å
83	G	32.4	Very low	31.4	Very low	43 Å²	43	96.4 Å²	96.4	44%	0.443	54%	0.538	S	S	.	.	S	Bend	trans	68.1	-11.4	148.9	0	0	0	0	0	119.8	R86	G83-R86 WeakPolarHBondContact O-CB 3.31Å
84	A	30.3	Very low	31.2	Very low	33 Å²	33	103 Å²	103	27%	0.273	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-104.3	6.7	-169	0	0	0	0	0	115.8	N78 S82 R86	N78-A84 HydrophobicContact CB-CB 3.65Å; N78-A84 CarbonylContact O-C 3.13Å; N78-A84 VanDerWaalsContact O-CA 3.27Å; N78-A84 WeakPolarHBondContact O-CA 3.48Å; N78-A84 VanDerWaalsContact O-CB 3.27Å; N78-A84 WeakPolarHBondContact O-CB 3.4Å; N78-A84 PolarHBondContact O-N 3.04Å; S82-A84 PolarHBondContact O-N 3.47Å; A84-R86 PolarHBondContact O-N 2.79Å
85	W	34.2	Very low	31.5	Very low	56 Å²	56	104.8 Å²	104.8	21%	0.212	59%	0.592	C	S	.	*	G	3₁₀ helix	trans	-48.9	-36.4	154.7	-56.8	99.9	0	0	0	111.2	N78 K79 K87 S88 E109 T113	N78-W85 PolarHBondContact O-N 2.98Å; K79-W85 HydrophobicContact CB-CD2 3.64Å; K79-W85 HydrophobicContact CB-CE3 3.7Å; K79-W85 HydrophobicContact CB-CG 4.41Å; K79-W85 HydrophobicContact CB-CH2 3.64Å; K79-W85 HydrophobicContact CB-CZ2 3.62Å; K79-W85 HydrophobicContact CB-CZ3 3.69Å; K79-W85 HydrophobicContact CD-CD2 4.31Å; K79-W85 HydrophobicContact CD-CE3 3.55Å; K79-W85 HydrophobicContact CD-CH2 4.19Å; K79-W85 HydrophobicContact CD-CZ3 3.46Å; K79-W85 VanDerWaalsContact CD-CZ3 3.46Å; K79-W85 HydrophobicContact CG-CD2 3.56Å; K79-W85 HydrophobicContact CG-CE3 3.31Å; K79-W85 HydrophobicContact CG-CG 4.21Å; K79-W85 HydrophobicContact CG-CH2 4.12Å; K79-W85 HydrophobicContact CG-CZ2 4.37Å; K79-W85 HydrophobicContact CG-CZ3 3.61Å; K79-W85 PolarHBondContact O-NE1 3.28Å; W85-K87 PolarHBondContact O-N 3.11Å; W85-S88 PolarHBondContact O-N 2.87Å; W85-E109 HydrophobicContact CD2-CG 4.26Å; W85-E109 HydrophobicContact CH2-CG 4.45Å; W85-E109 HydrophobicContact CZ2-CG 4.08Å; W85-E109 WeakPolarHBondContact CZ2-OE1 3.42Å; W85-E109 PolarHBondContact NE1-OE1 3.49Å; W85-E109 PolarHBondContact NE1-OE2 2.68Å; W85-E109 VanDerWaalsContact NE1-OE2 3.13Å; W85-T113 HydrophobicContact CE3-CG2 4.43Å; W85-T113 HydrophobicContact CH2-CG2 3.35Å; W85-T113 HydrophobicContact CZ2-CG2 4.37Å; W85-T113 HydrophobicContact CZ3-CG2 3.38Å
86	R	31.8	Very low	31.4	Very low	182 Å²	182	106.1 Å²	106.1	69%	0.687	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-61.4	15.5	-173.7	-154	-164.8	-58.2	-85	-2.5	116.7	G83 A84	G83-R86 WeakPolarHBondContact O-CB 3.31Å; A84-R86 PolarHBondContact O-N 2.79Å
87	K	30	Very low	31.8	Very low	191 Å²	191	110.1 Å²	110.1	83%	0.83	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-135.5	4.7	-176.1	-77.4	-165.4	173.3	-175.1	0	116	W85	W85-K87 PolarHBondContact O-N 3.11Å
88	S	29.8	Very low	32	Very low	90 Å²	90	108.8 Å²	108.8	63%	0.629	66%	0.659	S	S	*	*	S	Bend	trans	-107.4	14.8	-178.7	-162	0	0	0	0	115.6	W85	W85-S88 PolarHBondContact O-N 2.87Å
89	C	29.6	Very low	32.4	Very low	108 Å²	108	114.1 Å²	114.1	73%	0.73	68%	0.684	S	S	*	*			trans	-132.1	135.5	161.8	-74.7	0	0	0	0	108.2	P91	C89-P91 WeakPolarHBondContact O-CD 3.48Å
90	Q	25.8	Very low	33.3	Very low	197 Å²	197	117 Å²	117	92%	0.921	70%	0.698	S	S	*	*			trans	-96.2	114.2	163.1	-77.5	-167.4	-4.7	0	0	108.8
91	P	30.3	Very low	35.3	Very low	115 Å²	115	117.3 Å²	117.3	75%	0.747	70%	0.697	S	S	*	*			trans	-70.5	137.4	156.6	-7	24.4	0	0	0	108.5	C89	C89-P91 WeakPolarHBondContact O-CD 3.48Å
92	V	33.1	Very low	37.6	Very low	136 Å²	136	116.3 Å²	116.3	82%	0.824	69%	0.689	S	S	*	*			trans	-60.2	139.6	160.9	176	0	0	0	0	108	L94	V92-L94 PolarHBondContact O-N 3.27Å; V92-L94 VanDerWaalsContact O-N 3.13Å
93	T	31.7	Very low	40.1	Very low	132 Å²	132	112.6 Å²	112.6	81%	0.81	66%	0.66	S	S	*	*			trans	-62	112.8	-171.1	47.2	0	0	0	0	113
94	L	30.6	Very low	42.7	Very low	170 Å²	170	113.6 Å²	113.6	89%	0.89	65%	0.652	S	S	*	*			trans	-131.1	123.7	160.8	-85.6	167.3	0	0	0	109	V92	V92-L94 PolarHBondContact O-N 3.27Å; V92-L94 VanDerWaalsContact O-N 3.13Å
95	S	34.7	Very low	45.2	Very low	134 Å²	134	115.2 Å²	115.2	94%	0.937	65%	0.653	S	S	*	*			trans	-80.1	127.6	-176.2	-61.6	0	0	0	0	111.6
96	G	30.1	Very low	47.4	Very low	79 Å²	79	113.1 Å²	113.1	81%	0.814	65%	0.646	S	S	*	*			trans	-162.4	118.4	172.3	0	0	0	0	0	111.7
97	S	38	Very low	50.1	Low	133 Å²	133	104.6 Å²	104.6	93%	0.93	61%	0.614	S	S	*	*			trans	-89.5	118.9	178.7	54.6	0	0	0	0	111.2
98	G	36.2	Very low	52.7	Low	66 Å²	66	99 Å²	99	68%	0.68	59%	0.591	S	S	*	*			trans	-153.9	139.3	173.1	0	0	0	0	0	111.9	Q100	G98-Q100 PolarHBondContact O-N 2.74Å
99	M	42.1	Very low	55	Low	195 Å²	195	97.1 Å²	97.1	96%	0.961	57%	0.572	S	S	*	*			trans	-72.4	97.3	173.6	-72.8	176.8	62.5	0	0	109.4	E101	M99-E101 PolarHBondContact O-N 3.01Å
100	Q	52.4	Low	57.5	Low	128 Å²	128	92.4 Å²	92.4	60%	0.598	54%	0.54	S	S	*	.			trans	-63.7	124.3	172.3	-73.4	-177.1	-21.9	0	0	110.3	G98 K105	G98-Q100 PolarHBondContact O-N 2.74Å; Q100-K105 PolarHBondContact O-NZ 3.38Å; Q100-K105 VanDerWaalsContact OE1-CE 3.28Å
101	E	75.3	Confident	60.5	Low	86 Å²	86	83.3 Å²	83.3	40%	0.402	50%	0.498	S	S	.	.			trans	-47.4	134.9	166.8	-69.4	168.3	166.6	0	0	111.3	M99 E103 K104 K105 W176	M99-E101 PolarHBondContact O-N 3.01Å; E101-E103 HydrophobicContact CB-CG 4.41Å; E101-E103 WeakPolarHBondContact CB-OE2 3.19Å; E101-K104 HydrophobicContact CB-CB 4.09Å; E101-K105 PolarHBondContact O-NZ 2.97Å; E101-W176 PolarHBondContact OE2-NE1 3.2Å
102	P	80	Confident	62.8	Low	69 Å²	69	81.7 Å²	81.7	45%	0.448	48%	0.48	S	S	.	.	H	α-helix	trans	-64.4	-39.4	176.5	24.6	-33.4	0	0	0	113	K104 K105 K262	P102-K104 PolarHBondContact O-N 3.45Å; P102-K105 PolarHBondContact O-N 3.22Å; P102-K262 HydrophobicContact CB-CB 4.36Å; P102-K262 HydrophobicContact CB-CG 4.41Å
103	E	83.1	Confident	65	Low	22 Å²	22	76.1 Å²	76.1	10%	0.103	45%	0.446	C	S	.	.	H	α-helix	trans	-64.3	-38.6	-179.5	61.5	-91.3	-119.7	0	0	112.7	E101 K105 I106 V107 W176 Y259 L263 P264	E101-E103 HydrophobicContact CB-CG 4.41Å; E101-E103 WeakPolarHBondContact CB-OE2 3.19Å; E103-K105 PolarHBondContact O-N 2.88Å; E103-I106 PolarHBondContact O-N 3.34Å; E103-V107 PolarHBondContact O-N 3.46Å; E103-W176 HydrophobicContact CG-CZ2 4.25Å; E103-Y259 HydrophobicContact CB-CD2 4.08Å; E103-Y259 HydrophobicContact CB-CE2 3.71Å; E103-L263 HydrophobicContact CB-CD2 4.32Å; E103-L263 HydrophobicContact CG-CD2 4.35Å; E103-P264 WeakPolarHBondContact OE1-CD 3.45Å
104	K	87.3	Confident	67.7	Low	63 Å²	63	69.8 Å²	69.8	27%	0.274	41%	0.408	S	S	.	.	H	α-helix	trans	-60.3	-34.5	176.9	-171	175	-168.9	165.5	0	112.4	E101 P102 I106 V107 Q108 L173 W176	E101-K104 HydrophobicContact CB-CB 4.09Å; P102-K104 PolarHBondContact O-N 3.45Å; K104-I106 VanDerWaalsContact C-N 3.32Å; K104-I106 PolarHBondContact O-N 3.47Å; K104-V107 PolarHBondContact O-N 2.8Å; K104-Q108 PolarHBondContact O-N 2.8Å; K104-L173 HydrophobicContact CG-CD1 4.13Å; K104-W176 HydrophobicContact CB-CZ2 4.01Å; K104-W176 VanDerWaalsContact CD-CD1 3.44Å; K104-W176 HydrophobicContact CD-CD2 4.26Å; K104-W176 HydrophobicContact CD-CG 3.81Å; K104-W176 VanDerWaalsContact CE-CG 3.49Å; K104-W176 HydrophobicContact CG-CD2 4Å; K104-W176 HydrophobicContact CG-CG 4.09Å; K104-W176 HydrophobicContact CG-CZ2 4.36Å
105	K	83.1	Confident	70.4	Confident	68 Å²	68	65.8 Å²	65.8	30%	0.296	38%	0.384	S	S	.	.	H	α-helix	trans	-66.3	-35.3	179.8	-59.9	-177	-166.9	74.1	0	112	Q100 E101 P102 E103 Q108 E109	Q100-K105 PolarHBondContact O-NZ 3.38Å; Q100-K105 VanDerWaalsContact OE1-CE 3.28Å; E101-K105 PolarHBondContact O-NZ 2.97Å; P102-K105 PolarHBondContact O-N 3.22Å; E103-K105 PolarHBondContact O-N 2.88Å; K105-Q108 PolarHBondContact O-N 3.37Å; K105-E109 WeakPolarHBondContact O-CB 3.07Å; K105-E109 PolarHBondContact O-N 3.27Å
106	I	80.5	Confident	72.6	Confident	12 Å²	12	62.2 Å²	62.2	6%	0.062	36%	0.363	C	S	.	.	H	α-helix	trans	-71	-37	178.5	-60.1	167.9	0	0	0	110.4	E103 K104 E109 L110 L255 E258 Y259 K262	E103-I106 PolarHBondContact O-N 3.34Å; K104-I106 VanDerWaalsContact C-N 3.32Å; K104-I106 PolarHBondContact O-N 3.47Å; I106-E109 PolarHBondContact O-N 3.28Å; I106-L110 WeakPolarHBondContact O-CB 3.38Å; I106-L110 PolarHBondContact O-N 2.94Å; I106-L255 HydrophobicContact CG2-CB 4.42Å; I106-L255 HydrophobicContact CG2-CD2 4.18Å; I106-L255 WeakPolarHBondContact CG2-O 3.19Å; I106-E258 HydrophobicContact CD1-CB 4.11Å; I106-E258 HydrophobicContact CD1-CG 3.73Å; I106-Y259 HydrophobicContact CB-CD2 4.37Å; I106-Y259 HydrophobicContact CG2-CD2 4.48Å; I106-K262 HydrophobicContact CD1-CB 4.21Å; I106-K262 HydrophobicContact CD1-CG 3.51Å
107	V	88.3	Confident	75.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-68.8	-36.2	173.6	-178.3	0	0	0	0	111.7	E103 K104 L110 L111 L173 W176 I182 Y259	E103-V107 PolarHBondContact O-N 3.46Å; K104-V107 PolarHBondContact O-N 2.8Å; V107-L110 PolarHBondContact O-N 2.87Å; V107-L111 PolarHBondContact O-N 2.68Å; V107-L173 HydrophobicContact CG1-CD1 4.27Å; V107-W176 HydrophobicContact CB-CH2 4.26Å; V107-W176 HydrophobicContact CB-CZ3 3.99Å; V107-W176 HydrophobicContact CG1-CE3 4.42Å; V107-W176 HydrophobicContact CG1-CZ3 3.9Å; V107-W176 HydrophobicContact CG2-CH2 3.66Å; V107-W176 HydrophobicContact CG2-CZ3 3.71Å; V107-I182 HydrophobicContact CG1-CB 4.43Å; V107-I182 HydrophobicContact CG1-CD1 3.74Å; V107-I182 HydrophobicContact CG1-CG1 3.96Å; V107-I182 HydrophobicContact CG2-CB 3.89Å; V107-I182 HydrophobicContact CG2-CG1 4.13Å; V107-I182 HydrophobicContact CG2-CG2 3.86Å; V107-Y259 HydrophobicContact CG2-CD2 3.99Å; V107-Y259 HydrophobicContact CG2-CE2 3.58Å
108	Q	83.9	Confident	77.9	Confident	74 Å²	74	53.2 Å²	53.2	35%	0.346	29%	0.285	S	S	.	.	H	α-helix	trans	-65.5	-42.3	171.6	-176.9	170.9	-12.2	0	0	112	K104 K105 L111 E112 L173	K104-Q108 PolarHBondContact O-N 2.8Å; K105-Q108 PolarHBondContact O-N 3.37Å; Q108-L111 PolarHBondContact O-N 2.83Å; Q108-E112 HydrophobicContact CG-CG 4.37Å; Q108-E112 VanDerWaalsContact CG-OE1 3.31Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.38Å; Q108-E112 PolarHBondContact NE2-OE1 2.72Å; Q108-E112 WeakPolarHBondContact O-CB 3.27Å; Q108-E112 WeakPolarHBondContact O-CG 3.48Å; Q108-E112 PolarHBondContact O-N 3.29Å; Q108-L173 HydrophobicContact CB-CD1 4.42Å; Q108-L173 HydrophobicContact CB-CD2 4.04Å; Q108-L173 HydrophobicContact CG-CD2 4.09Å
109	E	79.7	Confident	80.4	Confident	51 Å²	51	52.8 Å²	52.8	24%	0.238	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-38.4	174.2	-173.1	172.6	142.1	0	0	112.2	W85 K105 I106 T113 L255	W85-E109 HydrophobicContact CD2-CG 4.26Å; W85-E109 HydrophobicContact CH2-CG 4.45Å; W85-E109 HydrophobicContact CZ2-CG 4.08Å; W85-E109 WeakPolarHBondContact CZ2-OE1 3.42Å; W85-E109 PolarHBondContact NE1-OE1 3.49Å; W85-E109 PolarHBondContact NE1-OE2 2.68Å; W85-E109 VanDerWaalsContact NE1-OE2 3.13Å; K105-E109 WeakPolarHBondContact O-CB 3.07Å; K105-E109 PolarHBondContact O-N 3.27Å; I106-E109 PolarHBondContact O-N 3.28Å; E109-T113 HydrophobicContact CG-CG2 4.41Å; E109-T113 WeakPolarHBondContact O-CB 3.5Å; E109-T113 VanDerWaalsContact O-CG2 3.24Å; E109-T113 WeakPolarHBondContact O-CG2 3.03Å; E109-T113 PolarHBondContact O-N 3.18Å; E109-T113 PolarHBondContact O-OG1 3.29Å; E109-L255 HydrophobicContact CG-CD2 4.2Å
110	L	81.9	Confident	82.6	Confident	9 Å²	9	46.2 Å²	46.2	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-46.5	172.4	178.6	63	0	0	0	111.3	I106 V107 T113 E114 L169 I182 I186 R248 Y252 L255	I106-L110 WeakPolarHBondContact O-CB 3.38Å; I106-L110 PolarHBondContact O-N 2.94Å; V107-L110 PolarHBondContact O-N 2.87Å; L110-T113 PolarHBondContact O-OG1 3.5Å; L110-T113 VanDerWaalsContact O-OG1 3.1Å; L110-E114 VanDerWaalsContact O-CB 3.26Å; L110-E114 WeakPolarHBondContact O-CB 3.34Å; L110-E114 PolarHBondContact O-N 2.69Å; L110-L169 HydrophobicContact CD2-CD1 4.44Å; L110-L169 HydrophobicContact CD2-CD2 3.82Å; L110-L169 HydrophobicContact CG-CD1 4Å; L110-L169 HydrophobicContact CG-CD2 4.28Å; L110-I182 HydrophobicContact CD2-CG1 4.43Å; L110-I186 HydrophobicContact CD2-CD1 3.84Å; L110-I186 HydrophobicContact CD2-CG1 4.45Å; L110-R248 PolarHBondContact O-NH2 3.27Å; L110-Y252 HydrophobicContact CD1-CD1 3.79Å; L110-Y252 HydrophobicContact CD1-CE1 3.97Å; L110-L255 HydrophobicContact CB-CD1 4.32Å; L110-L255 HydrophobicContact CD1-CD1 3.87Å
111	L	87.9	Confident	84.6	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-50.6	177.1	176.4	65.1	0	0	0	112.7	V107 Q108 T113 E114 Q115 L166 L169 Q170 L173	V107-L111 PolarHBondContact O-N 2.68Å; Q108-L111 PolarHBondContact O-N 2.83Å; L111-T113 VanDerWaalsContact C-N 3.29Å; L111-T113 PolarHBondContact O-N 3.27Å; L111-E114 WeakPolarHBondContact O-CB 3.46Å; L111-E114 PolarHBondContact O-N 3.12Å; L111-Q115 HydrophobicContact CD1-CG 4.45Å; L111-Q115 WeakPolarHBondContact O-CG 3.37Å; L111-Q115 PolarHBondContact O-N 3.19Å; L111-L166 HydrophobicContact CD1-CD1 3.57Å; L111-L169 HydrophobicContact CD1-CB 3.84Å; L111-Q170 HydrophobicContact CD1-CB 4.13Å; L111-L173 HydrophobicContact CD2-CB 4.13Å; L111-L173 HydrophobicContact CD2-CD2 3.48Å; L111-L173 VanDerWaalsContact CD2-CD2 3.48Å; L111-L173 HydrophobicContact CD2-CG 4.45Å
112	E	78.7	Confident	85.5	Confident	80 Å²	80	39.8 Å²	39.8	37%	0.374	21%	0.21	S	C	.	.	H	α-helix	trans	-61.8	-37.8	-179.7	-73	177.6	-162.8	0	0	111.5	Q108 A116	Q108-E112 HydrophobicContact CG-CG 4.37Å; Q108-E112 VanDerWaalsContact CG-OE1 3.31Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.38Å; Q108-E112 PolarHBondContact NE2-OE1 2.72Å; Q108-E112 WeakPolarHBondContact O-CB 3.27Å; Q108-E112 WeakPolarHBondContact O-CG 3.48Å; Q108-E112 PolarHBondContact O-N 3.29Å; E112-A116 PolarHBondContact O-N 2.75Å
113	T	79.2	Confident	86.1	Confident	19 Å²	19	36.8 Å²	36.8	12%	0.117	19%	0.19	C	C	.	.	H	α-helix	trans	-74.5	-26.6	173.5	60	0	0	0	0	113.2	W85 E109 L110 L111 Y117 R248	W85-T113 HydrophobicContact CE3-CG2 4.43Å; W85-T113 HydrophobicContact CH2-CG2 3.35Å; W85-T113 HydrophobicContact CZ2-CG2 4.37Å; W85-T113 HydrophobicContact CZ3-CG2 3.38Å; E109-T113 HydrophobicContact CG-CG2 4.41Å; E109-T113 WeakPolarHBondContact O-CB 3.5Å; E109-T113 VanDerWaalsContact O-CG2 3.24Å; E109-T113 WeakPolarHBondContact O-CG2 3.03Å; E109-T113 PolarHBondContact O-N 3.18Å; E109-T113 PolarHBondContact O-OG1 3.29Å; L110-T113 PolarHBondContact O-OG1 3.5Å; L110-T113 VanDerWaalsContact O-OG1 3.1Å; L111-T113 VanDerWaalsContact C-N 3.29Å; L111-T113 PolarHBondContact O-N 3.27Å; T113-Y117 VanDerWaalsContact O-CB 3.32Å; T113-Y117 WeakPolarHBondContact O-CB 3.21Å; T113-Y117 PolarHBondContact O-N 2.78Å; T113-R248 VanDerWaalsContact CB-NH1 3.31Å; T113-R248 PolarHBondContact OG1-NH1 3.48Å; T113-R248 PolarHBondContact OG1-NH2 2.99Å
114	E	89.5	Confident	86.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-72.2	-42.5	175.3	-169.3	61.8	-161.1	0	0	111.8	L110 L111 A116 Y117 V118 H161 F165 L166 L169 R248 Y252	L110-E114 VanDerWaalsContact O-CB 3.26Å; L110-E114 WeakPolarHBondContact O-CB 3.34Å; L110-E114 PolarHBondContact O-N 2.69Å; L111-E114 WeakPolarHBondContact O-CB 3.46Å; L111-E114 PolarHBondContact O-N 3.12Å; E114-A116 VanDerWaalsContact C-N 3.29Å; E114-A116 PolarHBondContact O-N 3.3Å; E114-Y117 PolarHBondContact O-N 3.34Å; E114-Y117 VanDerWaalsContact O-N 3.14Å; E114-V118 HydrophobicContact CG-CG2 4.41Å; E114-V118 WeakPolarHBondContact O-CB 3.43Å; E114-V118 WeakPolarHBondContact O-CG2 3.25Å; E114-V118 PolarHBondContact O-N 3.41Å; E114-H161 IonicContact OE1-CE1 2.7Å; E114-H161 IonicContact OE1-CG 3.67Å; E114-H161 IonicContact OE1-ND1 3.45Å; E114-H161 PolarHBondContact OE1-ND1 3.09Å; E114-F165 HydrophobicContact CG-CD1 3.98Å; E114-F165 HydrophobicContact CG-CE1 4.11Å; E114-F165 WeakPolarHBondContact OE1-CD1 3.37Å; E114-L166 HydrophobicContact CB-CD1 4.22Å; E114-L166 HydrophobicContact CG-CB 4Å; E114-L166 HydrophobicContact CG-CD1 4.08Å; E114-L169 HydrophobicContact CB-CD1 3.8Å; E114-L169 HydrophobicContact CG-CD1 3.91Å; E114-R248 IonicContact OE2-CZ 3.33Å; E114-R248 VanDerWaalsContact OE2-CZ 3.28Å; E114-R248 IonicContact OE2-NE 2.75Å; E114-R248 PolarHBondContact OE2-NE 3.21Å; E114-R248 VanDerWaalsContact OE2-NE 3.1Å; E114-R248 IonicContact OE2-NH2 2.75Å; E114-R248 PolarHBondContact OE2-NH2 3.29Å; E114-Y252 PolarHBondContact OE2-OH 2.87Å
115	Q	86.3	Confident	87	Confident	86 Å²	86	32.9 Å²	32.9	40%	0.402	17%	0.173	S	C	.	.	H	α-helix	trans	-56.4	-45	173.3	-69.1	172.8	-1.1	0	0	111.1	L111 A119 L166	L111-Q115 HydrophobicContact CD1-CG 4.45Å; L111-Q115 WeakPolarHBondContact O-CG 3.37Å; L111-Q115 PolarHBondContact O-N 3.19Å; Q115-A119 PolarHBondContact O-N 3.1Å; Q115-A119 VanDerWaalsContact O-N 3.12Å; Q115-L166 HydrophobicContact CG-CD1 3.56Å; Q115-L166 HydrophobicContact CG-CD2 4.26Å
116	A	80.7	Confident	87.6	Confident	58 Å²	58	33.6 Å²	33.6	48%	0.479	18%	0.177	S	C	.	.	H	α-helix	trans	-65.5	-39.6	175.8	0	0	0	0	0	112.8	E112 E114 A119 R120	E112-A116 PolarHBondContact O-N 2.75Å; E114-A116 VanDerWaalsContact C-N 3.29Å; E114-A116 PolarHBondContact O-N 3.3Å; A116-A119 PolarHBondContact O-N 3.41Å; A116-R120 PolarHBondContact O-N 3.13Å
117	Y	87.2	Confident	88.3	Confident	7 Å²	7	35.1 Å²	35.1	3%	0.027	19%	0.187	C	C	.	.	H	α-helix	trans	-67.5	-44.5	177.7	176.8	-123.7	0	0	0	112.2	T113 E114 A119 R120 L121 H161 Y196 E244 P245 R248	T113-Y117 VanDerWaalsContact O-CB 3.32Å; T113-Y117 WeakPolarHBondContact O-CB 3.21Å; T113-Y117 PolarHBondContact O-N 2.78Å; E114-Y117 PolarHBondContact O-N 3.34Å; E114-Y117 VanDerWaalsContact O-N 3.14Å; Y117-A119 VanDerWaalsContact C-N 3.27Å; Y117-A119 PolarHBondContact O-N 3.12Å; Y117-R120 WeakPolarHBondContact O-CA 3.25Å; Y117-R120 PolarHBondContact O-N 3.42Å; Y117-L121 HydrophobicContact CD1-CD1 3.96Å; Y117-L121 HydrophobicContact CD2-CG 4.33Å; Y117-L121 HydrophobicContact CE1-CD1 3.46Å; Y117-L121 VanDerWaalsContact CE1-CD1 3.46Å; Y117-L121 HydrophobicContact CE1-CG 4.14Å; Y117-L121 HydrophobicContact CE2-CD1 4.14Å; Y117-L121 HydrophobicContact CE2-CD2 4.04Å; Y117-L121 HydrophobicContact CE2-CG 3.88Å; Y117-L121 HydrophobicContact CG-CD1 4.49Å; Y117-L121 PolarHBondContact O-N 3.33Å; Y117-H161 AromaticContact CE1-CG 3.86Å; Y117-H161 AromaticContact CE1-ND1 3.87Å; Y117-Y196 WeakPolarHBondContact OH-CE1 3.18Å; Y117-Y196 PolarHBondContact OH-OH 2.96Å; Y117-E244 HydrophobicContact CE2-CB 4.43Å; Y117-P245 WeakPolarHBondContact OH-CA 3.41Å; Y117-R248 HydrophobicContact CD1-CB 4.47Å; Y117-R248 HydrophobicContact CD1-CG 3.7Å; Y117-R248 HydrophobicContact CD2-CB 4.27Å; Y117-R248 HydrophobicContact CD2-CG 4.22Å; Y117-R248 HydrophobicContact CE1-CB 4.06Å; Y117-R248 HydrophobicContact CE1-CG 3.59Å; Y117-R248 HydrophobicContact CE2-CB 3.86Å; Y117-R248 HydrophobicContact CE2-CG 4.14Å; Y117-R248 HydrophobicContact CG-CG 4.02Å
118	V	93.8	Very high	88.6	Confident	16 Å²	16	35 Å²	35	10%	0.097	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-36.9	174	166.9	0	0	0	0	111.5	E114 R120 L121 H122 Y158 H161 L166	E114-V118 HydrophobicContact CG-CG2 4.41Å; E114-V118 WeakPolarHBondContact O-CB 3.43Å; E114-V118 WeakPolarHBondContact O-CG2 3.25Å; E114-V118 PolarHBondContact O-N 3.41Å; V118-R120 VanDerWaalsContact C-N 3.34Å; V118-R120 PolarHBondContact O-N 3.46Å; V118-L121 PolarHBondContact O-N 2.95Å; V118-H122 WeakPolarHBondContact O-CB 3.22Å; V118-H122 PolarHBondContact O-N 3.42Å; V118-Y158 HydrophobicContact CG1-CE2 4.23Å; V118-H161 HydrophobicContact CG2-CB 3.93Å; V118-L166 HydrophobicContact CB-CD2 4.03Å; V118-L166 HydrophobicContact CG1-CD2 4.08Å; V118-L166 HydrophobicContact CG2-CB 4.19Å; V118-L166 HydrophobicContact CG2-CD2 3.92Å
119	A	88.7	Confident	89.2	Confident	58 Å²	58	32.2 Å²	32.2	48%	0.479	17%	0.173	S	C	.	.	H	α-helix	trans	-66.3	-32.1	173.4	0	0	0	0	0	113.3	Q115 A116 Y117 L123	Q115-A119 PolarHBondContact O-N 3.1Å; Q115-A119 VanDerWaalsContact O-N 3.12Å; A116-A119 PolarHBondContact O-N 3.41Å; Y117-A119 VanDerWaalsContact C-N 3.27Å; Y117-A119 PolarHBondContact O-N 3.12Å; A119-L123 PolarHBondContact O-N 3.43Å
120	R	87.3	Confident	89.9	Confident	57 Å²	57	32.3 Å²	32.3	22%	0.215	17%	0.174	C	C	.	.	H	α-helix	trans	-74.9	-39.1	172.6	-66.9	-62.8	179.9	-143.2	4.3	112.5	Y72 A116 Y117 V118 H122 L123 L124 A232	Y72-R120 PolarHBondContact OH-NH2 2.86Å; A116-R120 PolarHBondContact O-N 3.13Å; Y117-R120 WeakPolarHBondContact O-CA 3.25Å; Y117-R120 PolarHBondContact O-N 3.42Å; V118-R120 VanDerWaalsContact C-N 3.34Å; V118-R120 PolarHBondContact O-N 3.46Å; R120-H122 VanDerWaalsContact C-N 3.32Å; R120-H122 PolarHBondContact O-N 2.72Å; R120-L123 WeakPolarHBondContact O-CB 3.4Å; R120-L123 PolarHBondContact O-N 3.49Å; R120-L124 PolarHBondContact O-N 2.97Å; R120-A232 PolarHBondContact NH1-O 3.32Å
121	L	93.5	Very high	90.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-39.8	171.2	-70.6	176.3	0	0	0	111.9	Y117 V118 L124 D125 I154 I157 Y158 H161 P245	Y117-L121 HydrophobicContact CD1-CD1 3.96Å; Y117-L121 HydrophobicContact CD2-CG 4.33Å; Y117-L121 HydrophobicContact CE1-CD1 3.46Å; Y117-L121 VanDerWaalsContact CE1-CD1 3.46Å; Y117-L121 HydrophobicContact CE1-CG 4.14Å; Y117-L121 HydrophobicContact CE2-CD1 4.14Å; Y117-L121 HydrophobicContact CE2-CD2 4.04Å; Y117-L121 HydrophobicContact CE2-CG 3.88Å; Y117-L121 HydrophobicContact CG-CD1 4.49Å; Y117-L121 PolarHBondContact O-N 3.33Å; V118-L121 PolarHBondContact O-N 2.95Å; L121-L124 PolarHBondContact O-N 3.19Å; L121-D125 WeakPolarHBondContact O-CB 3.29Å; L121-D125 PolarHBondContact O-N 3.33Å; L121-I154 HydrophobicContact CD2-CD1 3.58Å; L121-I154 HydrophobicContact CD2-CG1 4.46Å; L121-I157 HydrophobicContact CD1-CG2 3.97Å; L121-I157 HydrophobicContact CD2-CG2 3.81Å; L121-Y158 HydrophobicContact CB-CD2 3.63Å; L121-Y158 HydrophobicContact CB-CG 4.27Å; L121-H161 HydrophobicContact CD1-CB 3.72Å; L121-P245 HydrophobicContact CD2-CG 3.99Å
122	H	94.6	Very high	90.9	Very high	79 Å²	79	33.8 Å²	33.8	37%	0.366	18%	0.18	S	C	.	.	H	α-helix	trans	-60.1	-44.2	172.9	-178.9	90.2	0	0	0	111.9	V118 R120 L124 Q126 V127 Y158	V118-H122 WeakPolarHBondContact O-CB 3.22Å; V118-H122 PolarHBondContact O-N 3.42Å; R120-H122 VanDerWaalsContact C-N 3.32Å; R120-H122 PolarHBondContact O-N 2.72Å; H122-L124 PolarHBondContact O-N 2.89Å; H122-Q126 WeakPolarHBondContact O-CA 3.34Å; H122-Q126 WeakPolarHBondContact O-CB 3.41Å; H122-Q126 PolarHBondContact O-N 3.3Å; H122-V127 PolarHBondContact O-N 3.43Å; H122-Y158 HydrophobicContact CB-CD2 4.43Å; H122-Y158 HydrophobicContact CB-CE2 3.68Å; H122-Y158 AromaticContact ND1-CZ 3.67Å; H122-Y158 PolarHBondContact ND1-OH 2.93Å
123	L	92.8	Very high	91.6	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.031	16%	0.164	C	C	.	.	I	π-helix	trans	-61.2	-42.6	175.9	178.9	69.9	0	0	0	112	A119 R120 V127 F128 A232 H241	A119-L123 PolarHBondContact O-N 3.43Å; R120-L123 WeakPolarHBondContact O-CB 3.4Å; R120-L123 PolarHBondContact O-N 3.49Å; L123-V127 HydrophobicContact CD1-CB 4.15Å; L123-V127 HydrophobicContact CD1-CG1 4.44Å; L123-V127 HydrophobicContact CD1-CG2 4.25Å; L123-V127 WeakPolarHBondContact O-CB 3.22Å; L123-F128 HydrophobicContact CD1-CD2 4.33Å; L123-F128 HydrophobicContact CD1-CE2 4.19Å; L123-F128 HydrophobicContact CD2-CE2 4.18Å; L123-F128 HydrophobicContact CG-CD2 3.99Å; L123-F128 HydrophobicContact CG-CE2 3.93Å; L123-F128 WeakPolarHBondContact O-CD2 3.35Å; L123-F128 PolarHBondContact O-N 3.29Å; L123-A232 HydrophobicContact CD1-CB 4.31Å; L123-H241 WeakPolarHBondContact CD2-CE1 3.29Å
124	L	94	Very high	92.3	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.176	C	C	.	.	I	π-helix	trans	-64.6	-53.3	176.5	-74.7	172.5	0	0	0	112.4	R120 L121 H122 F128 F129 F151 I154 L238 H241 M242 P245	R120-L124 PolarHBondContact O-N 2.97Å; L121-L124 PolarHBondContact O-N 3.19Å; H122-L124 PolarHBondContact O-N 2.89Å; L124-F128 WeakPolarHBondContact O-CB 3.38Å; L124-F129 WeakPolarHBondContact O-CB 3.42Å; L124-F129 PolarHBondContact O-N 2.95Å; L124-F151 HydrophobicContact CD2-CE1 4.45Å; L124-I154 HydrophobicContact CB-CG1 4.01Å; L124-I154 HydrophobicContact CD1-CD1 3.9Å; L124-I154 HydrophobicContact CD1-CG1 4.18Å; L124-L238 HydrophobicContact CD2-CD1 3.67Å; L124-H241 HydrophobicContact CD2-CB 3.65Å; L124-H241 HydrophobicContact CG-CB 4.14Å; L124-M242 HydrophobicContact CD2-CG 3.78Å; L124-P245 HydrophobicContact CD1-CG 4.16Å
125	D	96.1	Very high	92.5	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.181	C	C	.	.	I	π-helix	trans	-82.3	-55.9	-171.5	-179.4	58.3	0	0	0	112.6	L121 F129 Q130 I154 S155 Y158	L121-D125 WeakPolarHBondContact O-CB 3.29Å; L121-D125 PolarHBondContact O-N 3.33Å; D125-F129 WeakPolarHBondContact O-CB 3.36Å; D125-F129 WeakPolarHBondContact OD1-CD1 3.23Å; D125-Q130 WeakPolarHBondContact O-CG 3.34Å; D125-Q130 PolarHBondContact O-N 3.36Å; D125-I154 HydrophobicContact CB-CG2 4.36Å; D125-S155 WeakPolarHBondContact OD1-CA 3.4Å; D125-S155 VanDerWaalsContact OD1-CB 3.25Å; D125-S155 WeakPolarHBondContact OD1-CB 3.38Å; D125-S155 PolarHBondContact OD1-OG 2.94Å; D125-Y158 HydrophobicContact CB-CD1 4.12Å; D125-Y158 HydrophobicContact CB-CG 4.21Å; D125-Y158 VanDerWaalsContact OD2-CD1 3.22Å; D125-Y158 WeakPolarHBondContact OD2-CD1 3.49Å
126	Q	94.6	Very high	92.9	Very high	83 Å²	83	30.8 Å²	30.8	39%	0.388	16%	0.164	S	C	.	.	I	π-helix	trans	-82.7	-19.8	-170.8	-62.5	-67.5	-56.3	0	0	113.5	H122 Y158	H122-Q126 WeakPolarHBondContact O-CA 3.34Å; H122-Q126 WeakPolarHBondContact O-CB 3.41Å; H122-Q126 PolarHBondContact O-N 3.3Å; Q126-Y158 HydrophobicContact CG-CD1 4.15Å; Q126-Y158 HydrophobicContact CG-CE1 3.5Å
127	V	94.8	Very high	93.4	Very high	44 Å²	44	34.6 Å²	34.6	27%	0.267	17%	0.166	S	C	.	.	I	π-helix	trans	-105.9	-70.8	175.3	-168.5	0	0	0	0	111.3	H122 L123 E131 I227	H122-V127 PolarHBondContact O-N 3.43Å; L123-V127 HydrophobicContact CD1-CB 4.15Å; L123-V127 HydrophobicContact CD1-CG1 4.44Å; L123-V127 HydrophobicContact CD1-CG2 4.25Å; L123-V127 WeakPolarHBondContact O-CB 3.22Å; V127-E131 VanDerWaalsContact O-CB 3.22Å; V127-E131 WeakPolarHBondContact O-CB 3.44Å; V127-E131 VanDerWaalsContact O-CG 3.25Å; V127-E131 WeakPolarHBondContact O-CG 3.43Å; V127-E131 PolarHBondContact O-N 3.48Å; V127-I227 HydrophobicContact CG1-CD1 4.33Å; V127-I227 HydrophobicContact CG1-CG1 4.3Å; V127-I227 HydrophobicContact CG1-CG2 3.78Å
128	F	95.1	Very high	93.6	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.201	C	C	.	.	I	π-helix	trans	-62	-54.5	-173.6	-82.1	-73.7	0	0	0	113	L123 L124 L132 F151 L224 I227 Q228 L238 H241	L123-F128 HydrophobicContact CD1-CD2 4.33Å; L123-F128 HydrophobicContact CD1-CE2 4.19Å; L123-F128 HydrophobicContact CD2-CE2 4.18Å; L123-F128 HydrophobicContact CG-CD2 3.99Å; L123-F128 HydrophobicContact CG-CE2 3.93Å; L123-F128 WeakPolarHBondContact O-CD2 3.35Å; L123-F128 PolarHBondContact O-N 3.29Å; L124-F128 WeakPolarHBondContact O-CB 3.38Å; F128-L132 WeakPolarHBondContact O-CB 3.32Å; F128-L132 WeakPolarHBondContact O-CG 3.25Å; F128-L132 PolarHBondContact O-N 2.83Å; F128-L132 VanDerWaalsContact O-N 3.1Å; F128-F151 HydrophobicContact CB-CE1 3.89Å; F128-F151 HydrophobicContact CB-CZ 3.75Å; F128-L224 HydrophobicContact CD1-CD2 3.98Å; F128-L224 HydrophobicContact CE1-CD2 4.05Å; F128-I227 HydrophobicContact CD1-CB 4.06Å; F128-I227 HydrophobicContact CD1-CD1 3.91Å; F128-I227 HydrophobicContact CD1-CG2 3.74Å; F128-I227 HydrophobicContact CD2-CG2 4.08Å; F128-I227 HydrophobicContact CE1-CB 3.71Å; F128-I227 HydrophobicContact CE1-CD1 4.41Å; F128-I227 HydrophobicContact CE1-CG2 3.46Å; F128-I227 VanDerWaalsContact CE1-CG2 3.46Å; F128-I227 HydrophobicContact CE2-CG2 3.82Å; F128-I227 HydrophobicContact CG-CD1 4.49Å; F128-I227 HydrophobicContact CG-CG2 4.04Å; F128-I227 HydrophobicContact CZ-CB 4.17Å; F128-I227 HydrophobicContact CZ-CG2 3.51Å; F128-Q228 HydrophobicContact CE1-CG 4.2Å; F128-Q228 HydrophobicContact CZ-CG 4.06Å; F128-L238 HydrophobicContact CB-CD1 4.06Å; F128-L238 HydrophobicContact CD1-CB 4.33Å; F128-L238 HydrophobicContact CD1-CD1 4.09Å; F128-L238 HydrophobicContact CD1-CD2 4.31Å; F128-L238 HydrophobicContact CD1-CG 4.47Å; F128-L238 HydrophobicContact CD2-CD1 3.93Å; F128-L238 HydrophobicContact CE1-CB 4.04Å; F128-L238 HydrophobicContact CE1-CD1 4.48Å; F128-L238 HydrophobicContact CE2-CD1 4.34Å; F128-L238 HydrophobicContact CG-CD1 3.8Å; F128-L238 HydrophobicContact CZ-CB 4.27Å; F128-H241 AromaticContact CE2-CD2 3.77Å
129	F	96.2	Very high	92.8	Very high	15 Å²	15	45.5 Å²	45.5	7%	0.066	21%	0.212	C	C	.	.	I	π-helix	trans	-64.1	-49.2	-178.6	172.9	-120.1	0	0	0	112	L124 D125 E131 L132 L133 V147 R148 F151 S155	L124-F129 WeakPolarHBondContact O-CB 3.42Å; L124-F129 PolarHBondContact O-N 2.95Å; D125-F129 WeakPolarHBondContact O-CB 3.36Å; D125-F129 WeakPolarHBondContact OD1-CD1 3.23Å; F129-E131 PolarHBondContact O-N 3.02Å; F129-L132 PolarHBondContact O-N 2.58Å; F129-L133 HydrophobicContact CE1-CD2 4.48Å; F129-L133 HydrophobicContact CE2-CD2 4.49Å; F129-L133 HydrophobicContact CZ-CD2 4.13Å; F129-L133 WeakPolarHBondContact O-CB 3.49Å; F129-L133 PolarHBondContact O-N 2.89Å; F129-V147 HydrophobicContact CD2-CG1 3.68Å; F129-V147 HydrophobicContact CE2-CG1 3.96Å; F129-R148 HydrophobicContact CE2-CG 4.43Å; F129-F151 HydrophobicContact CB-CB 4.28Å; F129-F151 HydrophobicContact CB-CD1 3.73Å; F129-F151 HydrophobicContact CB-CD2 4.02Å; F129-F151 HydrophobicContact CB-CE1 3.99Å; F129-F151 HydrophobicContact CB-CE2 4.3Å; F129-F151 HydrophobicContact CB-CG 3.72Å; F129-F151 HydrophobicContact CB-CZ 4.28Å; F129-F151 HydrophobicContact CD2-CB 3.56Å; F129-F151 HydrophobicContact CD2-CD1 4.48Å; F129-F151 AromaticContact CD2-CD2 3.63Å; F129-F151 HydrophobicContact CD2-CD2 3.63Å; F129-F151 HydrophobicContact CD2-CE2 4.46Å; F129-F151 AromaticContact CD2-CG 3.63Å; F129-F151 HydrophobicContact CD2-CG 3.63Å; F129-F151 HydrophobicContact CE2-CB 4.1Å; F129-F151 HydrophobicContact CG-CB 4.07Å; F129-F151 HydrophobicContact CG-CD1 4.44Å; F129-F151 HydrophobicContact CG-CD2 4.28Å; F129-F151 HydrophobicContact CG-CG 4Å; F129-S155 WeakPolarHBondContact CE1-OG 3.37Å
130	Q	95	Very high	92.4	Very high	53 Å²	53	52 Å²	52	25%	0.248	23%	0.23	C	C	.	.	H	α-helix	trans	-64.2	-39.6	178.7	-66.9	-50.6	-41.7	0	0	114	D125 R134	D125-Q130 WeakPolarHBondContact O-CG 3.34Å; D125-Q130 PolarHBondContact O-N 3.36Å; Q130-R134 WeakPolarHBondContact O-CB 3.48Å; Q130-R134 PolarHBondContact O-N 3.43Å
131	E	94.9	Very high	92.3	Very high	47 Å²	47	51.3 Å²	51.3	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-66.4	-44.6	177.5	-75.3	-62.1	132.7	0	0	111.7	V127 F129 R134 A135 V223 R226 I227	V127-E131 VanDerWaalsContact O-CB 3.22Å; V127-E131 WeakPolarHBondContact O-CB 3.44Å; V127-E131 VanDerWaalsContact O-CG 3.25Å; V127-E131 WeakPolarHBondContact O-CG 3.43Å; V127-E131 PolarHBondContact O-N 3.48Å; F129-E131 PolarHBondContact O-N 3.02Å; E131-R134 PolarHBondContact O-N 3.34Å; E131-R134 IonicContact OE1-CZ 2.72Å; E131-R134 IonicContact OE1-NH1 3.5Å; E131-R134 PolarHBondContact OE1-NH1 3.24Å; E131-R134 IonicContact OE1-NH2 3.83Å; E131-R134 IonicContact OE2-NH1 3.81Å; E131-A135 WeakPolarHBondContact O-CB 3.49Å; E131-A135 PolarHBondContact O-N 3.27Å; E131-V223 HydrophobicContact CB-CG1 3.99Å; E131-R226 IonicContact OE2-CZ 3.8Å; E131-R226 IonicContact OE2-NH2 2.74Å; E131-R226 PolarHBondContact OE2-NH2 3.29Å; E131-I227 HydrophobicContact CB-CD1 3.76Å; E131-I227 HydrophobicContact CG-CD1 4.01Å
132	L	95.1	Very high	92.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-43.2	177.1	-72.4	168.5	0	0	0	111.6	F128 F129 R134 A135 A136 F142 V147 F151 F220 V223 L224 L238	F128-L132 WeakPolarHBondContact O-CB 3.32Å; F128-L132 WeakPolarHBondContact O-CG 3.25Å; F128-L132 PolarHBondContact O-N 2.83Å; F128-L132 VanDerWaalsContact O-N 3.1Å; F129-L132 PolarHBondContact O-N 2.58Å; L132-R134 VanDerWaalsContact C-N 3.31Å; L132-R134 PolarHBondContact O-N 3.18Å; L132-A135 PolarHBondContact O-N 2.87Å; L132-A136 PolarHBondContact O-N 3.06Å; L132-F142 HydrophobicContact CB-CE2 4.46Å; L132-F142 HydrophobicContact CD2-CE2 4.47Å; L132-F142 HydrophobicContact CD2-CZ 4.16Å; L132-F142 VanDerWaalsContact O-CE2 3.27Å; L132-F142 WeakPolarHBondContact O-CE2 3.28Å; L132-V147 HydrophobicContact CB-CG1 3.84Å; L132-V147 HydrophobicContact CB-CG2 4.28Å; L132-F151 HydrophobicContact CD1-CE2 3.71Å; L132-F151 HydrophobicContact CD1-CZ 3.99Å; L132-F220 HydrophobicContact CD1-CE2 4.31Å; L132-F220 HydrophobicContact CD1-CZ 4.49Å; L132-F220 HydrophobicContact CD2-CD2 3.77Å; L132-F220 HydrophobicContact CD2-CE2 3.9Å; L132-F220 HydrophobicContact CD2-CG 4.25Å; L132-V223 HydrophobicContact CD2-CB 3.99Å; L132-V223 HydrophobicContact CD2-CG1 3.65Å; L132-V223 HydrophobicContact CG-CG1 4.02Å; L132-L224 HydrophobicContact CD1-CD2 3.98Å; L132-L238 HydrophobicContact CD1-CD2 4.45Å
133	L	94.9	Very high	92.2	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-37	177.2	-165.7	69.9	0	0	0	111.7	F129 R137 E144 V147 R148	F129-L133 HydrophobicContact CE1-CD2 4.48Å; F129-L133 HydrophobicContact CE2-CD2 4.49Å; F129-L133 HydrophobicContact CZ-CD2 4.13Å; F129-L133 WeakPolarHBondContact O-CB 3.49Å; F129-L133 PolarHBondContact O-N 2.89Å; L133-R137 WeakPolarHBondContact O-CG 3.37Å; L133-R137 PolarHBondContact O-N 2.87Å; L133-E144 HydrophobicContact CD1-CB 3.9Å; L133-E144 HydrophobicContact CD1-CG 3.77Å; L133-E144 WeakPolarHBondContact CD1-OE2 3.44Å; L133-V147 HydrophobicContact CB-CG1 4.28Å; L133-V147 HydrophobicContact CD1-CB 4.26Å; L133-V147 HydrophobicContact CD1-CG1 4.38Å; L133-R148 HydrophobicContact CD1-CG 4.5Å
134	R	94.3	Very high	92.3	Very high	98 Å²	98	52.9 Å²	52.9	37%	0.37	25%	0.249	S	C	.	.	H	α-helix	trans	-71.9	-33.7	175.1	-159.7	-176.4	-53.2	134	9.1	112.3	Q130 E131 L132 R138	Q130-R134 WeakPolarHBondContact O-CB 3.48Å; Q130-R134 PolarHBondContact O-N 3.43Å; E131-R134 PolarHBondContact O-N 3.34Å; E131-R134 IonicContact OE1-CZ 2.72Å; E131-R134 IonicContact OE1-NH1 3.5Å; E131-R134 PolarHBondContact OE1-NH1 3.24Å; E131-R134 IonicContact OE1-NH2 3.83Å; E131-R134 IonicContact OE2-NH1 3.81Å; L132-R134 VanDerWaalsContact C-N 3.31Å; L132-R134 PolarHBondContact O-N 3.18Å; R134-R138 WeakPolarHBondContact O-CB 3.43Å; R134-R138 VanDerWaalsContact O-CG 3.27Å; R134-R138 WeakPolarHBondContact O-CG 3.32Å; R134-R138 PolarHBondContact O-N 3.19Å
135	A	93.4	Very high	92.3	Very high	13 Å²	13	58.1 Å²	58.1	11%	0.107	28%	0.277	C	S	.	.	H	α-helix	trans	-69.7	-41.7	173.7	0	0	0	0	0	112.2	E131 L132 R137 R138 S139 F142 V223	E131-A135 WeakPolarHBondContact O-CB 3.49Å; E131-A135 PolarHBondContact O-N 3.27Å; L132-A135 PolarHBondContact O-N 2.87Å; A135-R137 PolarHBondContact O-N 2.99Å; A135-R138 PolarHBondContact O-N 3.43Å; A135-S139 WeakPolarHBondContact O-CB 3.44Å; A135-S139 PolarHBondContact O-N 2.98Å; A135-S139 VanDerWaalsContact O-N 3.12Å; A135-S139 PolarHBondContact O-OG 3.27Å; A135-F142 HydrophobicContact CB-CE1 4.45Å; A135-F142 HydrophobicContact CB-CZ 3.85Å; A135-V223 HydrophobicContact CB-CG2 4.03Å
136	A	93.4	Very high	92.2	Very high	4 Å²	4	59 Å²	59	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-54.3	-53.9	172.2	0	0	0	0	0	111.1	L132 R138 S139 K140 F142 E144 V147	L132-A136 PolarHBondContact O-N 3.06Å; A136-R138 VanDerWaalsContact C-N 3.3Å; A136-R138 PolarHBondContact O-N 3.01Å; A136-S139 PolarHBondContact O-N 3.03Å; A136-K140 PolarHBondContact O-N 3.12Å; A136-F142 HydrophobicContact CB-CD2 3.79Å; A136-F142 HydrophobicContact CB-CE2 3.65Å; A136-F142 HydrophobicContact CB-CZ 4.39Å; A136-F142 WeakPolarHBondContact CB-O 3.46Å; A136-E144 HydrophobicContact CB-CG 4.21Å; A136-V147 HydrophobicContact CB-CG2 4.44Å
137	R	92.7	Very high	92.2	Very high	139 Å²	139	55 Å²	55	53%	0.525	26%	0.263	S	S	.	.	H	α-helix	trans	-55.3	-39.8	177.9	-77.3	174.6	-177.6	157	14.5	114	L133 A135 E144	L133-R137 WeakPolarHBondContact O-CG 3.37Å; L133-R137 PolarHBondContact O-N 2.87Å; A135-R137 PolarHBondContact O-N 2.99Å; R137-E144 WeakPolarHBondContact CD-OE1 3.5Å; R137-E144 HydrophobicContact CG-CG 4.17Å; R137-E144 WeakPolarHBondContact CG-OE1 3.33Å; R137-E144 IonicContact CZ-OE1 3.52Å; R137-E144 IonicContact CZ-OE2 3.11Å; R137-E144 IonicContact NE-OE1 2.72Å; R137-E144 PolarHBondContact NE-OE1 3.48Å; R137-E144 IonicContact NE-OE2 3.65Å; R137-E144 PolarHBondContact NE-OE2 3.03Å; R137-E144 IonicContact NH2-OE1 2.74Å; R137-E144 IonicContact NH2-OE2 3.64Å; R137-E144 PolarHBondContact NH2-OE2 3.47Å
138	R	91.4	Very high	92.2	Very high	203 Å²	203	58.2 Å²	58.2	77%	0.766	27%	0.271	S	S	*	.	H	α-helix	trans	-77.4	-27.9	-177.1	-76.5	173.3	173.4	-174.3	-2.6	113.9	R134 A135 A136	R134-R138 WeakPolarHBondContact O-CB 3.43Å; R134-R138 VanDerWaalsContact O-CG 3.27Å; R134-R138 WeakPolarHBondContact O-CG 3.32Å; R134-R138 PolarHBondContact O-N 3.19Å; A135-R138 PolarHBondContact O-N 3.43Å; A136-R138 VanDerWaalsContact C-N 3.3Å; A136-R138 PolarHBondContact O-N 3.01Å
139	S	76.4	Confident	92.2	Very high	48 Å²	48	60 Å²	60	34%	0.336	28%	0.281	S	S	.	.	H	α-helix	trans	-120.2	-24.9	-164	65.5	0	0	0	0	115.6	A135 A136 A141 L219	A135-S139 WeakPolarHBondContact O-CB 3.44Å; A135-S139 PolarHBondContact O-N 2.98Å; A135-S139 VanDerWaalsContact O-N 3.12Å; A135-S139 PolarHBondContact O-OG 3.27Å; A136-S139 PolarHBondContact O-N 3.03Å; S139-A141 PolarHBondContact O-N 2.93Å; S139-A141 VanDerWaalsContact O-N 3.08Å; S139-A141 WeakPolarHBondContact OG-CB 3.39Å; S139-A141 PolarHBondContact OG-N 3.24Å; S139-A141 VanDerWaalsContact OG-N 3.1Å; S139-L219 VanDerWaalsContact CB-CD2 3.41Å; S139-L219 WeakPolarHBondContact OG-CD2 3.38Å
140	K	80	Confident	92	Very high	196 Å²	196	59.3 Å²	59.3	85%	0.852	28%	0.278	S	S	*	.			trans	53.9	12.6	-162.8	-58.5	-173.7	177.8	-177.2	0	114.9	A136 F142	A136-K140 PolarHBondContact O-N 3.12Å; K140-F142 PolarHBondContact O-N 3.26Å
141	A	85.3	Confident	92	Very high	42 Å²	42	56.9 Å²	56.9	35%	0.347	27%	0.267	S	S	.	.	S	Bend	trans	-69.3	-15.7	-178.6	0	0	0	0	0	113.4	S139 S217 L219	S139-A141 PolarHBondContact O-N 2.93Å; S139-A141 VanDerWaalsContact O-N 3.08Å; S139-A141 WeakPolarHBondContact OG-CB 3.39Å; S139-A141 PolarHBondContact OG-N 3.24Å; S139-A141 VanDerWaalsContact OG-N 3.1Å; A141-S217 PolarHBondContact O-OG 2.89Å; A141-L219 HydrophobicContact CB-CB 4.5Å; A141-L219 HydrophobicContact CB-CD2 4.14Å
142	F	92.6	Very high	91.9	Very high	4 Å²	4	56 Å²	56	2%	0.018	27%	0.266	C	S	.	.	S	Bend	trans	-156	150.5	169.6	49.1	-86.2	0	0	0	109.4	L132 A135 A136 K140 V147 W213 F220	L132-F142 HydrophobicContact CB-CE2 4.46Å; L132-F142 HydrophobicContact CD2-CE2 4.47Å; L132-F142 HydrophobicContact CD2-CZ 4.16Å; L132-F142 VanDerWaalsContact O-CE2 3.27Å; L132-F142 WeakPolarHBondContact O-CE2 3.28Å; A135-F142 HydrophobicContact CB-CE1 4.45Å; A135-F142 HydrophobicContact CB-CZ 3.85Å; A136-F142 HydrophobicContact CB-CD2 3.79Å; A136-F142 HydrophobicContact CB-CE2 3.65Å; A136-F142 HydrophobicContact CB-CZ 4.39Å; A136-F142 WeakPolarHBondContact CB-O 3.46Å; K140-F142 PolarHBondContact O-N 3.26Å; F142-V147 HydrophobicContact CD2-CG2 3.73Å; F142-V147 HydrophobicContact CE2-CG2 3.62Å; F142-W213 HydrophobicContact CB-CD2 4.22Å; F142-W213 HydrophobicContact CB-CE3 3.57Å; F142-W213 HydrophobicContact CB-CH2 4.34Å; F142-W213 HydrophobicContact CB-CZ3 3.64Å; F142-F220 HydrophobicContact CD1-CB 3.87Å; F142-F220 AromaticContact CD1-CD2 3.95Å; F142-F220 HydrophobicContact CD1-CD2 3.95Å; F142-F220 HydrophobicContact CD1-CG 4.4Å; F142-F220 AromaticContact CD2-CD2 3.78Å; F142-F220 HydrophobicContact CD2-CD2 3.78Å; F142-F220 HydrophobicContact CD2-CE2 4.3Å; F142-F220 HydrophobicContact CE1-CB 3.73Å; F142-F220 AromaticContact CE1-CD2 3.87Å; F142-F220 HydrophobicContact CE1-CD2 3.87Å; F142-F220 HydrophobicContact CE1-CG 4.3Å; F142-F220 AromaticContact CE2-CD2 3.67Å; F142-F220 HydrophobicContact CE2-CD2 3.67Å; F142-F220 HydrophobicContact CE2-CE2 4.24Å; F142-F220 AromaticContact CG-CD2 3.91Å; F142-F220 HydrophobicContact CG-CD2 3.91Å; F142-F220 HydrophobicContact CZ-CB 4.32Å; F142-F220 AromaticContact CZ-CD2 3.72Å; F142-F220 HydrophobicContact CZ-CD2 3.72Å; F142-F220 HydrophobicContact CZ-CG 4.48Å
143	P	93.7	Very high	91.8	Very high	59 Å²	59	56.7 Å²	56.7	38%	0.383	27%	0.27	S	S	.	.			trans	-69.2	150.5	-179.6	-19.1	32.1	0	0	0	113.6	D145 V146 W213	P143-D145 VanDerWaalsContact C-N 3.25Å; P143-D145 PolarHBondContact O-N 3.17Å; P143-V146 HydrophobicContact CB-CG2 4.16Å; P143-V146 HydrophobicContact CG-CG2 3.96Å; P143-V146 PolarHBondContact O-N 3.49Å; P143-W213 HydrophobicContact CG-CZ2 4.5Å
144	E	94.4	Very high	91.9	Very high	55 Å²	55	56.4 Å²	56.4	26%	0.257	27%	0.268	S	S	.	.	H	α-helix	trans	-59.4	-37.5	168.2	-77.2	-164.6	-140.7	0	0	112	L133 A136 R137 V146 V147 R148	L133-E144 HydrophobicContact CD1-CB 3.9Å; L133-E144 HydrophobicContact CD1-CG 3.77Å; L133-E144 WeakPolarHBondContact CD1-OE2 3.44Å; A136-E144 HydrophobicContact CB-CG 4.21Å; R137-E144 WeakPolarHBondContact CD-OE1 3.5Å; R137-E144 HydrophobicContact CG-CG 4.17Å; R137-E144 WeakPolarHBondContact CG-OE1 3.33Å; R137-E144 IonicContact CZ-OE1 3.52Å; R137-E144 IonicContact CZ-OE2 3.11Å; R137-E144 IonicContact NE-OE1 2.72Å; R137-E144 PolarHBondContact NE-OE1 3.48Å; R137-E144 IonicContact NE-OE2 3.65Å; R137-E144 PolarHBondContact NE-OE2 3.03Å; R137-E144 IonicContact NH2-OE1 2.74Å; R137-E144 IonicContact NH2-OE2 3.64Å; R137-E144 PolarHBondContact NH2-OE2 3.47Å; E144-V146 VanDerWaalsContact C-N 3.26Å; E144-V146 PolarHBondContact O-N 2.87Å; E144-V147 WeakPolarHBondContact O-CA 3.37Å; E144-V147 WeakPolarHBondContact O-CB 3.42Å; E144-V147 PolarHBondContact O-N 3.42Å; E144-R148 WeakPolarHBondContact O-CG 3.37Å; E144-R148 PolarHBondContact O-N 3.25Å; E144-R148 IonicContact OE2-CZ 3.9Å; E144-R148 IonicContact OE2-NE 2.95Å; E144-R148 IonicContact OE2-NH2 3.44Å; E144-R148 PolarHBondContact OE2-NH2 2.86Å
145	D	94	Very high	91.9	Very high	111 Å²	111	53 Å²	53	59%	0.594	26%	0.259	S	S	*	.	H	α-helix	trans	-65.8	-30.4	-176.2	-54.1	-49.7	0	0	0	112.5	P143 R148 V149	P143-D145 VanDerWaalsContact C-N 3.25Å; P143-D145 PolarHBondContact O-N 3.17Å; D145-R148 PolarHBondContact O-N 3Å; D145-V149 VanDerWaalsContact O-CG2 3.29Å; D145-V149 WeakPolarHBondContact O-CG2 3.26Å; D145-V149 PolarHBondContact O-N 3.4Å
146	V	93.6	Very high	91.9	Very high	18 Å²	18	54.2 Å²	54.2	11%	0.109	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-45.5	171.3	166.7	0	0	0	0	110.3	P143 E144 R148 V149 I150 W213	P143-V146 HydrophobicContact CB-CG2 4.16Å; P143-V146 HydrophobicContact CG-CG2 3.96Å; P143-V146 PolarHBondContact O-N 3.49Å; E144-V146 VanDerWaalsContact C-N 3.26Å; E144-V146 PolarHBondContact O-N 2.87Å; V146-R148 VanDerWaalsContact C-N 3.35Å; V146-V149 PolarHBondContact O-N 3.49Å; V146-I150 HydrophobicContact CG1-CD1 3.88Å; V146-I150 VanDerWaalsContact O-CG1 3.31Å; V146-I150 WeakPolarHBondContact O-CG1 3.32Å; V146-I150 PolarHBondContact O-N 2.87Å; V146-W213 HydrophobicContact CG1-CD2 4.28Å; V146-W213 HydrophobicContact CG1-CG 3.85Å; V146-W213 HydrophobicContact CG2-CZ2 4.07Å
147	V	95.5	Very high	92	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-43.5	177.1	-172.2	0	0	0	0	110.2	F129 L132 L133 A136 F142 E144 V149 I150 F151	F129-V147 HydrophobicContact CD2-CG1 3.68Å; F129-V147 HydrophobicContact CE2-CG1 3.96Å; L132-V147 HydrophobicContact CB-CG1 3.84Å; L132-V147 HydrophobicContact CB-CG2 4.28Å; L133-V147 HydrophobicContact CB-CG1 4.28Å; L133-V147 HydrophobicContact CD1-CB 4.26Å; L133-V147 HydrophobicContact CD1-CG1 4.38Å; A136-V147 HydrophobicContact CB-CG2 4.44Å; F142-V147 HydrophobicContact CD2-CG2 3.73Å; F142-V147 HydrophobicContact CE2-CG2 3.62Å; E144-V147 WeakPolarHBondContact O-CA 3.37Å; E144-V147 WeakPolarHBondContact O-CB 3.42Å; E144-V147 PolarHBondContact O-N 3.42Å; V147-V149 PolarHBondContact O-N 3Å; V147-I150 PolarHBondContact O-N 3.23Å; V147-F151 HydrophobicContact CG1-CD2 4.05Å; V147-F151 HydrophobicContact CG1-CE2 4.28Å; V147-F151 WeakPolarHBondContact O-CD2 3.14Å; V147-F151 PolarHBondContact O-N 3.33Å; V147-F151 VanDerWaalsContact O-N 3.1Å
148	R	95.1	Very high	92.2	Very high	112 Å²	112	49.1 Å²	49.1	42%	0.423	25%	0.247	S	C	.	.	H	α-helix	trans	-61.7	-40.3	176.3	-66.3	169.4	-171.7	-87.8	2.2	112.4	F129 L133 E144 D145 V146 S152	F129-R148 HydrophobicContact CE2-CG 4.43Å; L133-R148 HydrophobicContact CD1-CG 4.5Å; E144-R148 WeakPolarHBondContact O-CG 3.37Å; E144-R148 PolarHBondContact O-N 3.25Å; E144-R148 IonicContact OE2-CZ 3.9Å; E144-R148 IonicContact OE2-NE 2.95Å; E144-R148 IonicContact OE2-NH2 3.44Å; E144-R148 PolarHBondContact OE2-NH2 2.86Å; D145-R148 PolarHBondContact O-N 3Å; V146-R148 VanDerWaalsContact C-N 3.35Å; R148-S152 WeakPolarHBondContact O-CA 3.03Å; R148-S152 PolarHBondContact O-N 3.47Å
149	V	93.5	Very high	92.3	Very high	36 Å²	36	43 Å²	43	22%	0.218	23%	0.227	C	C	.	.	H	α-helix	trans	-72.3	-35.5	176.4	177.3	0	0	0	0	111.8	D145 V146 V147 F151 N202 R205 L209	D145-V149 VanDerWaalsContact O-CG2 3.29Å; D145-V149 WeakPolarHBondContact O-CG2 3.26Å; D145-V149 PolarHBondContact O-N 3.4Å; V146-V149 PolarHBondContact O-N 3.49Å; V147-V149 PolarHBondContact O-N 3Å; V149-F151 VanDerWaalsContact C-N 3.35Å; V149-F151 PolarHBondContact O-N 3.45Å; V149-N202 PolarHBondContact O-ND2 3.46Å; V149-R205 HydrophobicContact CG1-CG 4.38Å; V149-L209 HydrophobicContact CB-CD1 3.9Å; V149-L209 HydrophobicContact CG1-CD1 3.43Å; V149-L209 VanDerWaalsContact CG1-CD1 3.43Å
150	I	92.2	Very high	93.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-42.4	175.7	-70.6	168.3	0	0	0	111.1	V146 V147 A206 L209 L210 F220 M242	V146-I150 HydrophobicContact CG1-CD1 3.88Å; V146-I150 VanDerWaalsContact O-CG1 3.31Å; V146-I150 WeakPolarHBondContact O-CG1 3.32Å; V146-I150 PolarHBondContact O-N 2.87Å; V147-I150 PolarHBondContact O-N 3.23Å; I150-A206 VanDerWaalsContact O-CB 3.27Å; I150-A206 WeakPolarHBondContact O-CB 3.4Å; I150-L209 HydrophobicContact CD1-CB 4.01Å; I150-L209 HydrophobicContact CG1-CB 3.66Å; I150-L209 HydrophobicContact CG1-CD1 4.46Å; I150-L210 HydrophobicContact CD1-CB 4.32Å; I150-L210 HydrophobicContact CG2-CB 4.39Å; I150-F220 HydrophobicContact CD1-CE2 4.25Å; I150-F220 HydrophobicContact CD1-CZ 3.78Å; I150-M242 HydrophobicContact CG2-CE 4.16Å; I150-M242 HydrophobicContact CG2-SD 4.37Å; I150-M242 WeakPolarHBondContact O-CE 3.27Å
151	F	94.9	Very high	93.9	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-93.1	-10	-175.4	-73.3	-87.3	0	0	0	114.6	L124 F128 F129 L132 V147 V149 N153 I154 L238	L124-F151 HydrophobicContact CD2-CE1 4.45Å; F128-F151 HydrophobicContact CB-CE1 3.89Å; F128-F151 HydrophobicContact CB-CZ 3.75Å; F129-F151 HydrophobicContact CB-CB 4.28Å; F129-F151 HydrophobicContact CB-CD1 3.73Å; F129-F151 HydrophobicContact CB-CD2 4.02Å; F129-F151 HydrophobicContact CB-CE1 3.99Å; F129-F151 HydrophobicContact CB-CE2 4.3Å; F129-F151 HydrophobicContact CB-CG 3.72Å; F129-F151 HydrophobicContact CB-CZ 4.28Å; F129-F151 HydrophobicContact CD2-CB 3.56Å; F129-F151 HydrophobicContact CD2-CD1 4.48Å; F129-F151 AromaticContact CD2-CD2 3.63Å; F129-F151 HydrophobicContact CD2-CD2 3.63Å; F129-F151 HydrophobicContact CD2-CE2 4.46Å; F129-F151 AromaticContact CD2-CG 3.63Å; F129-F151 HydrophobicContact CD2-CG 3.63Å; F129-F151 HydrophobicContact CE2-CB 4.1Å; F129-F151 HydrophobicContact CG-CB 4.07Å; F129-F151 HydrophobicContact CG-CD1 4.44Å; F129-F151 HydrophobicContact CG-CD2 4.28Å; F129-F151 HydrophobicContact CG-CG 4Å; L132-F151 HydrophobicContact CD1-CE2 3.71Å; L132-F151 HydrophobicContact CD1-CZ 3.99Å; V147-F151 HydrophobicContact CG1-CD2 4.05Å; V147-F151 HydrophobicContact CG1-CE2 4.28Å; V147-F151 WeakPolarHBondContact O-CD2 3.14Å; V147-F151 PolarHBondContact O-N 3.33Å; V147-F151 VanDerWaalsContact O-N 3.1Å; V149-F151 VanDerWaalsContact C-N 3.35Å; V149-F151 PolarHBondContact O-N 3.45Å; F151-N153 PolarHBondContact O-N 3.38Å; F151-I154 HydrophobicContact CB-CG2 3.8Å; F151-I154 HydrophobicContact CD1-CG2 4.12Å; F151-I154 HydrophobicContact CG-CG2 4.44Å; F151-I154 VanDerWaalsContact O-CB 3.26Å; F151-I154 WeakPolarHBondContact O-CB 3.24Å; F151-I154 WeakPolarHBondContact O-CG2 3.37Å; F151-I154 PolarHBondContact O-N 3.01Å; F151-I154 VanDerWaalsContact O-N 3.1Å; F151-L238 HydrophobicContact CE1-CD1 3.76Å; F151-L238 HydrophobicContact CE1-CD2 4.29Å; F151-L238 HydrophobicContact CE2-CD2 4.21Å; F151-L238 HydrophobicContact CZ-CD1 3.81Å; F151-L238 HydrophobicContact CZ-CD2 3.53Å; F151-L238 HydrophobicContact CZ-CG 4.3Å
152	S	93.6	Very high	94.4	Very high	29 Å²	29	31.4 Å²	31.4	20%	0.203	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	-133.3	176.8	-170.2	0	0	0	0	111.4	R148	R148-S152 WeakPolarHBondContact O-CA 3.03Å; R148-S152 PolarHBondContact O-N 3.47Å
153	N	93.7	Very high	94.5	Very high	14 Å²	14	36.9 Å²	36.9	8%	0.075	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	24.5	177.8	70.6	2.6	0	0	0	114.1	F151 S155 S156 I157 M195 E198	F151-N153 PolarHBondContact O-N 3.38Å; N153-S155 PolarHBondContact O-N 2.7Å; N153-S155 VanDerWaalsContact O-N 3.1Å; N153-S156 WeakPolarHBondContact O-CB 3.43Å; N153-S156 PolarHBondContact O-N 2.77Å; N153-I157 PolarHBondContact O-N 2.92Å; N153-M195 PolarHBondContact ND2-O 3.4Å; N153-E198 PolarHBondContact ND2-OE2 3.19Å
154	I	95.2	Very high	94.4	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-55.2	-33.1	-177	-164.1	60.8	0	0	0	113.2	L121 L124 D125 F151 S156 I157 Y158 Y199 P245	L121-I154 HydrophobicContact CD2-CD1 3.58Å; L121-I154 HydrophobicContact CD2-CG1 4.46Å; L124-I154 HydrophobicContact CB-CG1 4.01Å; L124-I154 HydrophobicContact CD1-CD1 3.9Å; L124-I154 HydrophobicContact CD1-CG1 4.18Å; D125-I154 HydrophobicContact CB-CG2 4.36Å; F151-I154 HydrophobicContact CB-CG2 3.8Å; F151-I154 HydrophobicContact CD1-CG2 4.12Å; F151-I154 HydrophobicContact CG-CG2 4.44Å; F151-I154 VanDerWaalsContact O-CB 3.26Å; F151-I154 WeakPolarHBondContact O-CB 3.24Å; F151-I154 WeakPolarHBondContact O-CG2 3.37Å; F151-I154 PolarHBondContact O-N 3.01Å; F151-I154 VanDerWaalsContact O-N 3.1Å; I154-S156 VanDerWaalsContact C-N 3.31Å; I154-S156 PolarHBondContact O-N 2.76Å; I154-I157 HydrophobicContact CD1-CB 4.42Å; I154-I157 HydrophobicContact CD1-CD1 4.37Å; I154-I157 PolarHBondContact O-N 2.82Å; I154-Y158 WeakPolarHBondContact O-CB 3.33Å; I154-Y158 PolarHBondContact O-N 3.32Å; I154-Y199 HydrophobicContact CB-CE2 4.17Å; I154-Y199 HydrophobicContact CD1-CD2 4.44Å; I154-Y199 HydrophobicContact CD1-CE2 3.85Å; I154-Y199 HydrophobicContact CG1-CE2 4.44Å; I154-P245 HydrophobicContact CD1-CG 3.74Å
155	S	94.9	Very high	94.3	Very high	26 Å²	26	35.8 Å²	35.8	18%	0.182	18%	0.18	C	C	.	.	H	α-helix	trans	-62.2	-39.2	176.5	-47	0	0	0	0	111.8	D125 F129 N153 Y158 Q159	D125-S155 WeakPolarHBondContact OD1-CA 3.4Å; D125-S155 VanDerWaalsContact OD1-CB 3.25Å; D125-S155 WeakPolarHBondContact OD1-CB 3.38Å; D125-S155 PolarHBondContact OD1-OG 2.94Å; F129-S155 WeakPolarHBondContact CE1-OG 3.37Å; N153-S155 PolarHBondContact O-N 2.7Å; N153-S155 VanDerWaalsContact O-N 3.1Å; S155-Y158 PolarHBondContact O-N 3Å; S155-Q159 WeakPolarHBondContact O-CB 3.33Å; S155-Q159 VanDerWaalsContact O-CG 3.23Å; S155-Q159 WeakPolarHBondContact O-CG 3.27Å; S155-Q159 PolarHBondContact O-N 3.15Å
156	S	94.8	Very high	94.3	Very high	39 Å²	39	32 Å²	32	27%	0.273	16%	0.16	S	C	.	.	H	α-helix	trans	-67.2	-40.9	176	-49.5	0	0	0	0	111.1	N153 I154 F160	N153-S156 WeakPolarHBondContact O-CB 3.43Å; N153-S156 PolarHBondContact O-N 2.77Å; I154-S156 VanDerWaalsContact C-N 3.31Å; I154-S156 PolarHBondContact O-N 2.76Å; S156-F160 WeakPolarHBondContact O-CB 3.27Å; S156-F160 PolarHBondContact O-N 3.1Å
157	I	93.9	Very high	94.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-49.3	174	-59.8	175.9	0	0	0	110	L121 N153 I154 F160 H161 M195 Y196 Y199	L121-I157 HydrophobicContact CD1-CG2 3.97Å; L121-I157 HydrophobicContact CD2-CG2 3.81Å; N153-I157 PolarHBondContact O-N 2.92Å; I154-I157 HydrophobicContact CD1-CB 4.42Å; I154-I157 HydrophobicContact CD1-CD1 4.37Å; I154-I157 PolarHBondContact O-N 2.82Å; I157-F160 PolarHBondContact O-N 3.18Å; I157-H161 WeakPolarHBondContact O-CB 3.44Å; I157-H161 PolarHBondContact O-CD2 2.67Å; I157-H161 VanDerWaalsContact O-CD2 3.25Å; I157-H161 PolarHBondContact O-N 3.39Å; I157-M195 HydrophobicContact CB-CE 4.33Å; I157-M195 HydrophobicContact CG1-CE 4.1Å; I157-M195 HydrophobicContact CG1-CG 3.99Å; I157-M195 HydrophobicContact CG1-SD 4.05Å; I157-M195 HydrophobicContact CG2-CE 4.4Å; I157-Y196 HydrophobicContact CD1-CD1 4.17Å; I157-Y196 HydrophobicContact CD1-CE1 4.27Å; I157-Y196 HydrophobicContact CD1-CG 4.38Å; I157-Y196 HydrophobicContact CG2-CE1 4.08Å; I157-Y196 HydrophobicContact CG2-CE2 4.23Å; I157-Y196 WeakPolarHBondContact CG2-OH 3.38Å; I157-Y199 HydrophobicContact CD1-CD2 4.07Å; I157-Y199 HydrophobicContact CD1-CG 4.04Å
158	Y	96.6	Very high	94.3	Very high	36 Å²	36	35.8 Å²	35.8	14%	0.141	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-48.4	178	174.1	-119.4	0	0	0	112.6	V118 L121 H122 D125 Q126 I154 S155 H161 S162	V118-Y158 HydrophobicContact CG1-CE2 4.23Å; L121-Y158 HydrophobicContact CB-CD2 3.63Å; L121-Y158 HydrophobicContact CB-CG 4.27Å; H122-Y158 HydrophobicContact CB-CD2 4.43Å; H122-Y158 HydrophobicContact CB-CE2 3.68Å; H122-Y158 AromaticContact ND1-CZ 3.67Å; H122-Y158 PolarHBondContact ND1-OH 2.93Å; D125-Y158 HydrophobicContact CB-CD1 4.12Å; D125-Y158 HydrophobicContact CB-CG 4.21Å; D125-Y158 VanDerWaalsContact OD2-CD1 3.22Å; D125-Y158 WeakPolarHBondContact OD2-CD1 3.49Å; Q126-Y158 HydrophobicContact CG-CD1 4.15Å; Q126-Y158 HydrophobicContact CG-CE1 3.5Å; I154-Y158 WeakPolarHBondContact O-CB 3.33Å; I154-Y158 PolarHBondContact O-N 3.32Å; S155-Y158 PolarHBondContact O-N 3Å; Y158-H161 PolarHBondContact O-N 3.14Å; Y158-S162 VanDerWaalsContact O-CB 3.24Å; Y158-S162 WeakPolarHBondContact O-CB 3.12Å; Y158-S162 PolarHBondContact O-N 2.96Å; Y158-S162 PolarHBondContact O-OG 3.31Å
159	Q	95.1	Very high	94.2	Very high	74 Å²	74	30.5 Å²	30.5	35%	0.346	16%	0.162	S	C	.	.	H	α-helix	trans	-60	-48.7	178.5	-74.2	172.4	10.3	0	0	111.4	S155 H161 Q163	S155-Q159 WeakPolarHBondContact O-CB 3.33Å; S155-Q159 VanDerWaalsContact O-CG 3.23Å; S155-Q159 WeakPolarHBondContact O-CG 3.27Å; S155-Q159 PolarHBondContact O-N 3.15Å; Q159-H161 PolarHBondContact O-N 2.88Å; Q159-Q163 WeakPolarHBondContact O-CB 3.31Å; Q159-Q163 WeakPolarHBondContact O-CG 3.35Å; Q159-Q163 PolarHBondContact O-N 3.37Å
160	F	94.6	Very high	94.2	Very high	18 Å²	18	31.9 Å²	31.9	8%	0.079	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-48.8	178.4	171.4	-89.3	0	0	0	112.1	S156 I157 F164 F165 L189 F192 M195	S156-F160 WeakPolarHBondContact O-CB 3.27Å; S156-F160 PolarHBondContact O-N 3.1Å; I157-F160 PolarHBondContact O-N 3.18Å; F160-F164 HydrophobicContact CD2-CB 4.48Å; F160-F164 HydrophobicContact CE2-CB 4.45Å; F160-F164 WeakPolarHBondContact O-CB 3.15Å; F160-F164 PolarHBondContact O-N 3.1Å; F160-F165 HydrophobicContact CE1-CB 3.8Å; F160-F165 HydrophobicContact CE1-CG 4.44Å; F160-F165 HydrophobicContact CZ-CB 3.99Å; F160-F165 PolarHBondContact O-N 2.94Å; F160-F165 VanDerWaalsContact O-N 3.15Å; F160-L189 HydrophobicContact CE1-CD1 3.29Å; F160-L189 HydrophobicContact CZ-CD1 3.53Å; F160-F192 HydrophobicContact CD2-CB 3.94Å; F160-F192 AromaticContact CD2-CD1 3.99Å; F160-F192 HydrophobicContact CD2-CD1 3.99Å; F160-F192 HydrophobicContact CD2-CD2 4.16Å; F160-F192 AromaticContact CD2-CG 3.76Å; F160-F192 HydrophobicContact CD2-CG 3.76Å; F160-F192 HydrophobicContact CE1-CB 4.41Å; F160-F192 HydrophobicContact CE2-CB 3.71Å; F160-F192 HydrophobicContact CE2-CD1 4.1Å; F160-F192 AromaticContact CE2-CD2 3.43Å; F160-F192 HydrophobicContact CE2-CD2 3.43Å; F160-F192 VanDerWaalsContact CE2-CD2 3.43Å; F160-F192 HydrophobicContact CE2-CE2 4.04Å; F160-F192 AromaticContact CE2-CG 3.47Å; F160-F192 HydrophobicContact CE2-CG 3.47Å; F160-F192 VanDerWaalsContact CE2-CG 3.47Å; F160-F192 HydrophobicContact CG-CB 4.38Å; F160-F192 HydrophobicContact CZ-CB 3.99Å; F160-F192 HydrophobicContact CZ-CD2 4.05Å; F160-F192 HydrophobicContact CZ-CG 4.17Å; F160-M195 HydrophobicContact CB-CE 3.99Å; F160-M195 HydrophobicContact CB-SD 4.47Å; F160-M195 HydrophobicContact CD1-CE 3.71Å; F160-M195 HydrophobicContact CG-CE 3.95Å
161	H	94.9	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-69.5	-41.4	-177.4	-80.9	-77.9	0	0	0	112.7	E114 Y117 V118 L121 I157 Y158 Q159 F165 L166 Y196 Y252	E114-H161 IonicContact OE1-CE1 2.7Å; E114-H161 IonicContact OE1-CG 3.67Å; E114-H161 IonicContact OE1-ND1 3.45Å; E114-H161 PolarHBondContact OE1-ND1 3.09Å; Y117-H161 AromaticContact CE1-CG 3.86Å; Y117-H161 AromaticContact CE1-ND1 3.87Å; V118-H161 HydrophobicContact CG2-CB 3.93Å; L121-H161 HydrophobicContact CD1-CB 3.72Å; I157-H161 WeakPolarHBondContact O-CB 3.44Å; I157-H161 PolarHBondContact O-CD2 2.67Å; I157-H161 VanDerWaalsContact O-CD2 3.25Å; I157-H161 PolarHBondContact O-N 3.39Å; Y158-H161 PolarHBondContact O-N 3.14Å; Q159-H161 PolarHBondContact O-N 2.88Å; H161-F165 AromaticContact ND1-CD1 3.68Å; H161-L166 VanDerWaalsContact O-CB 3.26Å; H161-L166 WeakPolarHBondContact O-CB 3.4Å; H161-L166 PolarHBondContact O-N 3.1Å; H161-Y196 PolarHBondContact CD2-OH 3.1Å; H161-Y196 VanDerWaalsContact CD2-OH 3.24Å; H161-Y196 AromaticContact NE2-CE2 3.77Å; H161-Y196 AromaticContact NE2-CZ 3.67Å; H161-Y196 PolarHBondContact NE2-OH 3.22Å; H161-Y252 AromaticContact CE1-CZ 3.89Å; H161-Y252 PolarHBondContact CE1-OH 3.28Å; H161-Y252 PolarHBondContact ND1-OH 2.84Å
162	S	95.7	Very high	94.1	Very high	25 Å²	25	37.2 Å²	37.2	18%	0.175	19%	0.186	C	C	.	.	I	π-helix	trans	-78.2	-36.6	-177.9	62.5	0	0	0	0	114.7	Y158 P167	Y158-S162 VanDerWaalsContact O-CB 3.24Å; Y158-S162 WeakPolarHBondContact O-CB 3.12Å; Y158-S162 PolarHBondContact O-N 2.96Å; Y158-S162 PolarHBondContact O-OG 3.31Å; S162-P167 WeakPolarHBondContact O-CD 3.39Å
163	Q	93.8	Very high	94	Very high	118 Å²	118	37 Å²	37	55%	0.551	18%	0.183	S	C	*	.	I	π-helix	trans	-97.4	-23.3	-172.1	-56.8	178.2	2.7	0	0	113.6	Q159	Q159-Q163 WeakPolarHBondContact O-CB 3.31Å; Q159-Q163 WeakPolarHBondContact O-CG 3.35Å; Q159-Q163 PolarHBondContact O-N 3.37Å
164	F	92.3	Very high	93.8	Very high	85 Å²	85	41.7 Å²	41.7	37%	0.373	21%	0.207	S	C	.	.	I	π-helix	trans	-120.8	-56.5	-174	-58.9	-95.2	0	0	0	112.9	L15 F160 E168	L15-F164 HydrophobicContact CD1-CE1 4.21Å; L15-F164 HydrophobicContact CD2-CE1 3.93Å; L15-F164 HydrophobicContact CD2-CE2 4.3Å; L15-F164 HydrophobicContact CD2-CZ 3.8Å; L15-F164 HydrophobicContact CG-CE1 4.02Å; L15-F164 HydrophobicContact CG-CZ 4.22Å; F160-F164 HydrophobicContact CD2-CB 4.48Å; F160-F164 HydrophobicContact CE2-CB 4.45Å; F160-F164 WeakPolarHBondContact O-CB 3.15Å; F160-F164 PolarHBondContact O-N 3.1Å; F164-E168 WeakPolarHBondContact O-CB 3.28Å; F164-E168 PolarHBondContact O-N 2.76Å
165	F	93.3	Very high	93.7	Very high	7 Å²	7	44.5 Å²	44.5	3%	0.031	22%	0.223	C	C	.	.	I	π-helix	trans	-74.6	-50.8	-171.1	-176.7	-123.7	0	0	0	113.1	E114 F160 H161 E168 L169 V185 L189 Y252	E114-F165 HydrophobicContact CG-CD1 3.98Å; E114-F165 HydrophobicContact CG-CE1 4.11Å; E114-F165 WeakPolarHBondContact OE1-CD1 3.37Å; F160-F165 HydrophobicContact CE1-CB 3.8Å; F160-F165 HydrophobicContact CE1-CG 4.44Å; F160-F165 HydrophobicContact CZ-CB 3.99Å; F160-F165 PolarHBondContact O-N 2.94Å; F160-F165 VanDerWaalsContact O-N 3.15Å; H161-F165 AromaticContact ND1-CD1 3.68Å; F165-E168 PolarHBondContact O-N 3.22Å; F165-L169 HydrophobicContact CD1-CD1 4.23Å; F165-L169 HydrophobicContact CD2-CG 4.26Å; F165-L169 HydrophobicContact CE1-CD1 3.69Å; F165-L169 HydrophobicContact CE1-CG 4.22Å; F165-L169 HydrophobicContact CE2-CD1 4.22Å; F165-L169 HydrophobicContact CE2-CD2 3.75Å; F165-L169 HydrophobicContact CE2-CG 3.86Å; F165-L169 HydrophobicContact CZ-CD1 3.67Å; F165-L169 HydrophobicContact CZ-CD2 3.79Å; F165-L169 HydrophobicContact CZ-CG 3.84Å; F165-L169 WeakPolarHBondContact O-CG 3.39Å; F165-L169 PolarHBondContact O-N 3.18Å; F165-V185 HydrophobicContact CD2-CG1 4.33Å; F165-V185 HydrophobicContact CE2-CG1 4.1Å; F165-L189 HydrophobicContact CD1-CD1 4.36Å; F165-L189 HydrophobicContact CD2-CB 4.03Å; F165-L189 HydrophobicContact CD2-CD1 4.27Å; F165-L189 HydrophobicContact CD2-CD2 4.42Å; F165-L189 HydrophobicContact CD2-CG 4.47Å; F165-L189 HydrophobicContact CE1-CD2 4.06Å; F165-L189 HydrophobicContact CE2-CB 3.96Å; F165-L189 HydrophobicContact CE2-CD2 3.85Å; F165-L189 HydrophobicContact CE2-CG 4.32Å; F165-L189 HydrophobicContact CG-CD1 4.2Å; F165-L189 HydrophobicContact CZ-CD2 3.66Å; F165-Y252 AromaticContact CE1-CE1 3.79Å; F165-Y252 HydrophobicContact CE1-CE1 3.79Å; F165-Y252 HydrophobicContact CZ-CE1 4.31Å
166	L	93.9	Very high	93.4	Very high	30 Å²	30	43.5 Å²	43.5	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-45.1	178.3	172.8	60.6	0	0	0	113	L111 E114 Q115 V118 H161 E168 L169 Q170	L111-L166 HydrophobicContact CD1-CD1 3.57Å; E114-L166 HydrophobicContact CB-CD1 4.22Å; E114-L166 HydrophobicContact CG-CB 4Å; E114-L166 HydrophobicContact CG-CD1 4.08Å; Q115-L166 HydrophobicContact CG-CD1 3.56Å; Q115-L166 HydrophobicContact CG-CD2 4.26Å; V118-L166 HydrophobicContact CB-CD2 4.03Å; V118-L166 HydrophobicContact CG1-CD2 4.08Å; V118-L166 HydrophobicContact CG2-CB 4.19Å; V118-L166 HydrophobicContact CG2-CD2 3.92Å; H161-L166 VanDerWaalsContact O-CB 3.26Å; H161-L166 WeakPolarHBondContact O-CB 3.4Å; H161-L166 PolarHBondContact O-N 3.1Å; L166-E168 PolarHBondContact O-N 2.86Å; L166-L169 PolarHBondContact O-N 3.44Å; L166-Q170 PolarHBondContact O-N 3.03Å
167	P	95.1	Very high	93	Very high	61 Å²	61	48.1 Å²	48.1	40%	0.396	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-39.7	175.3	-27.7	37.8	0	0	0	114.5	S162 Q170 R171	S162-P167 WeakPolarHBondContact O-CD 3.39Å; P167-Q170 PolarHBondContact O-N 2.9Å; P167-R171 VanDerWaalsContact O-CB 3.29Å; P167-R171 WeakPolarHBondContact O-CB 3.45Å; P167-R171 PolarHBondContact O-N 3.36Å
168	E	93.7	Very high	92.7	Very high	37 Å²	37	51.9 Å²	51.9	17%	0.173	27%	0.272	C	S	.	.	H	α-helix	trans	-71.8	-32.5	178	177.7	72.6	164.4	0	0	112.1	F164 F165 L166 R171 R172 V185 K188	F164-E168 WeakPolarHBondContact O-CB 3.28Å; F164-E168 PolarHBondContact O-N 2.76Å; F165-E168 PolarHBondContact O-N 3.22Å; L166-E168 PolarHBondContact O-N 2.86Å; E168-R171 VanDerWaalsContact CD-NH2 3.29Å; E168-R171 IonicContact OE1-NH2 2.77Å; E168-R171 PolarHBondContact OE1-NH2 2.98Å; E168-R171 VanDerWaalsContact OE1-NH2 3.11Å; E168-R171 IonicContact OE2-CZ 3.2Å; E168-R171 IonicContact OE2-NE 2.75Å; E168-R171 PolarHBondContact OE2-NE 3.27Å; E168-R171 IonicContact OE2-NH2 3.89Å; E168-R171 PolarHBondContact OE2-NH2 3.19Å; E168-R172 WeakPolarHBondContact O-CB 3.36Å; E168-R172 PolarHBondContact O-N 2.97Å; E168-R172 VanDerWaalsContact O-N 3.1Å; E168-R172 IonicContact OE1-NH2 3.47Å; E168-V185 HydrophobicContact CB-CG1 4.28Å; E168-V185 HydrophobicContact CG-CB 4.2Å; E168-V185 HydrophobicContact CG-CG1 3.51Å; E168-V185 HydrophobicContact CG-CG2 3.75Å; E168-K188 IonicContact OE1-NZ 3.7Å; E168-K188 PolarHBondContact OE1-NZ 2.89Å
169	L	92.6	Very high	92.3	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-48.6	169.1	-71.8	-174.4	0	0	0	111.8	L110 L111 E114 F165 L166 R172 L173 I182 V185	L110-L169 HydrophobicContact CD2-CD1 4.44Å; L110-L169 HydrophobicContact CD2-CD2 3.82Å; L110-L169 HydrophobicContact CG-CD1 4Å; L110-L169 HydrophobicContact CG-CD2 4.28Å; L111-L169 HydrophobicContact CD1-CB 3.84Å; E114-L169 HydrophobicContact CB-CD1 3.8Å; E114-L169 HydrophobicContact CG-CD1 3.91Å; F165-L169 HydrophobicContact CD1-CD1 4.23Å; F165-L169 HydrophobicContact CD2-CG 4.26Å; F165-L169 HydrophobicContact CE1-CD1 3.69Å; F165-L169 HydrophobicContact CE1-CG 4.22Å; F165-L169 HydrophobicContact CE2-CD1 4.22Å; F165-L169 HydrophobicContact CE2-CD2 3.75Å; F165-L169 HydrophobicContact CE2-CG 3.86Å; F165-L169 HydrophobicContact CZ-CD1 3.67Å; F165-L169 HydrophobicContact CZ-CD2 3.79Å; F165-L169 HydrophobicContact CZ-CG 3.84Å; F165-L169 WeakPolarHBondContact O-CG 3.39Å; F165-L169 PolarHBondContact O-N 3.18Å; L166-L169 PolarHBondContact O-N 3.44Å; L169-R172 PolarHBondContact O-N 3.01Å; L169-L173 PolarHBondContact O-N 3.16Å; L169-L173 VanDerWaalsContact O-N 3.07Å; L169-I182 HydrophobicContact CD2-CD1 3.84Å; L169-I182 HydrophobicContact CD2-CG1 4.3Å; L169-V185 HydrophobicContact CD2-CG1 4.09Å
170	Q	93.9	Very high	91.9	Very high	66 Å²	66	52.1 Å²	52.1	31%	0.308	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-54.5	180	-177.8	64.9	64.2	0	0	110.1	L111 L166 P167 R172 L173 D174	L111-Q170 HydrophobicContact CD1-CB 4.13Å; L166-Q170 PolarHBondContact O-N 3.03Å; P167-Q170 PolarHBondContact O-N 2.9Å; Q170-R172 PolarHBondContact O-N 3.13Å; Q170-R172 VanDerWaalsContact O-N 3.12Å; Q170-L173 PolarHBondContact O-N 2.99Å; Q170-D174 PolarHBondContact NE2-OD1 2.82Å; Q170-D174 PolarHBondContact O-N 3.45Å
171	R	93.3	Very high	91.7	Very high	111 Å²	111	53.8 Å²	53.8	42%	0.419	29%	0.288	S	S	.	.	H	α-helix	trans	-54.7	-34.2	177.8	-168.1	-166.7	68	75.9	-4.4	112.5	P167 E168 D175	P167-R171 VanDerWaalsContact O-CB 3.29Å; P167-R171 WeakPolarHBondContact O-CB 3.45Å; P167-R171 PolarHBondContact O-N 3.36Å; E168-R171 VanDerWaalsContact CD-NH2 3.29Å; E168-R171 IonicContact OE1-NH2 2.77Å; E168-R171 PolarHBondContact OE1-NH2 2.98Å; E168-R171 VanDerWaalsContact OE1-NH2 3.11Å; E168-R171 IonicContact OE2-CZ 3.2Å; E168-R171 IonicContact OE2-NE 2.75Å; E168-R171 PolarHBondContact OE2-NE 3.27Å; E168-R171 IonicContact OE2-NH2 3.89Å; E168-R171 PolarHBondContact OE2-NH2 3.19Å; R171-D175 VanDerWaalsContact O-CB 3.3Å; R171-D175 WeakPolarHBondContact O-CB 3.47Å; R171-D175 PolarHBondContact O-N 3.22Å
172	R	91.8	Very high	91.6	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-74	-36.1	177	-173.6	56.1	59.7	84.9	4.4	113.4	E168 L169 Q170 W176 N179 R181 I182 D184 V185	E168-R172 WeakPolarHBondContact O-CB 3.36Å; E168-R172 PolarHBondContact O-N 2.97Å; E168-R172 VanDerWaalsContact O-N 3.1Å; E168-R172 IonicContact OE1-NH2 3.47Å; L169-R172 PolarHBondContact O-N 3.01Å; Q170-R172 PolarHBondContact O-N 3.13Å; Q170-R172 VanDerWaalsContact O-N 3.12Å; R172-W176 PolarHBondContact O-N 3.4Å; R172-W176 VanDerWaalsContact O-N 3.15Å; R172-N179 WeakPolarHBondContact CD-O 3.28Å; R172-N179 PolarHBondContact NE-ND2 3.33Å; R172-R181 WeakPolarHBondContact CD-O 3.41Å; R172-R181 WeakPolarHBondContact CG-O 3.39Å; R172-R181 PolarHBondContact NH1-O 2.96Å; R172-I182 HydrophobicContact CB-CD1 4Å; R172-I182 HydrophobicContact CG-CD1 3.66Å; R172-D184 IonicContact CZ-OD1 3.94Å; R172-D184 IonicContact CZ-OD2 2.68Å; R172-D184 IonicContact NH1-OD1 3.79Å; R172-D184 PolarHBondContact NH1-OD1 2.79Å; R172-D184 IonicContact NH1-OD2 2.73Å; R172-D184 PolarHBondContact NH1-OD2 3.47Å; R172-D184 IonicContact NH2-OD1 3.19Å; R172-D184 IonicContact NH2-OD2 2.79Å; R172-D184 PolarHBondContact NH2-OD2 2.79Å; R172-V185 VanDerWaalsContact NH2-CG2 3.34Å
173	L	90.3	Very high	91.4	Very high	25 Å²	25	52.7 Å²	52.7	13%	0.131	28%	0.281	C	S	.	.	H	α-helix	trans	-73.1	-33.8	177.8	-166	67.3	0	0	0	111.6	K104 V107 Q108 L111 L169 Q170 W176	K104-L173 HydrophobicContact CG-CD1 4.13Å; V107-L173 HydrophobicContact CG1-CD1 4.27Å; Q108-L173 HydrophobicContact CB-CD1 4.42Å; Q108-L173 HydrophobicContact CB-CD2 4.04Å; Q108-L173 HydrophobicContact CG-CD2 4.09Å; L111-L173 HydrophobicContact CD2-CB 4.13Å; L111-L173 HydrophobicContact CD2-CD2 3.48Å; L111-L173 VanDerWaalsContact CD2-CD2 3.48Å; L111-L173 HydrophobicContact CD2-CG 4.45Å; L169-L173 PolarHBondContact O-N 3.16Å; L169-L173 VanDerWaalsContact O-N 3.07Å; Q170-L173 PolarHBondContact O-N 2.99Å; L173-W176 WeakPolarHBondContact O-CB 3.4Å; L173-W176 PolarHBondContact O-N 2.83Å
174	D	91.1	Very high	91.3	Very high	111 Å²	111	48.6 Å²	48.6	59%	0.594	26%	0.262	S	S	*	.	H	α-helix	trans	-64	-42.8	173.7	-57.1	-24	0	0	0	111.3	Q170 W176	Q170-D174 PolarHBondContact NE2-OD1 2.82Å; Q170-D174 PolarHBondContact O-N 3.45Å; D174-W176 VanDerWaalsContact C-N 3.34Å; D174-W176 PolarHBondContact O-N 2.68Å
175	D	91.5	Very high	91.3	Very high	61 Å²	61	44.6 Å²	44.6	33%	0.326	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	7.2	179.9	-170.6	42.8	0	0	0	114.1	R171 T177 A178 N179	R171-D175 VanDerWaalsContact O-CB 3.3Å; R171-D175 WeakPolarHBondContact O-CB 3.47Å; R171-D175 PolarHBondContact O-N 3.22Å; D175-T177 PolarHBondContact O-N 3.46Å; D175-A178 PolarHBondContact O-N 2.7Å; D175-N179 PolarHBondContact O-N 3.05Å; D175-N179 WeakPolarHBondContact OD2-CB 3.23Å
176	W	89.6	Confident	91.2	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.015	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-32.5	-167.5	-172.6	-86	0	0	0	114.5	E101 E103 K104 V107 R172 L173 D174 A178 N179 P180 Y259	E101-W176 PolarHBondContact OE2-NE1 3.2Å; E103-W176 HydrophobicContact CG-CZ2 4.25Å; K104-W176 HydrophobicContact CB-CZ2 4.01Å; K104-W176 VanDerWaalsContact CD-CD1 3.44Å; K104-W176 HydrophobicContact CD-CD2 4.26Å; K104-W176 HydrophobicContact CD-CG 3.81Å; K104-W176 VanDerWaalsContact CE-CG 3.49Å; K104-W176 HydrophobicContact CG-CD2 4Å; K104-W176 HydrophobicContact CG-CG 4.09Å; K104-W176 HydrophobicContact CG-CZ2 4.36Å; V107-W176 HydrophobicContact CB-CH2 4.26Å; V107-W176 HydrophobicContact CB-CZ3 3.99Å; V107-W176 HydrophobicContact CG1-CE3 4.42Å; V107-W176 HydrophobicContact CG1-CZ3 3.9Å; V107-W176 HydrophobicContact CG2-CH2 3.66Å; V107-W176 HydrophobicContact CG2-CZ3 3.71Å; R172-W176 PolarHBondContact O-N 3.4Å; R172-W176 VanDerWaalsContact O-N 3.15Å; L173-W176 WeakPolarHBondContact O-CB 3.4Å; L173-W176 PolarHBondContact O-N 2.83Å; D174-W176 VanDerWaalsContact C-N 3.34Å; D174-W176 PolarHBondContact O-N 2.68Å; W176-A178 VanDerWaalsContact C-N 3.3Å; W176-A178 PolarHBondContact O-N 3.18Å; W176-N179 CarbonylContact O-C 3.59Å; W176-N179 PolarHBondContact O-N 3.08Å; W176-P180 HydrophobicContact CD2-CB 4.28Å; W176-P180 HydrophobicContact CG-CB 4.49Å; W176-P180 HydrophobicContact CZ2-CB 4.02Å; W176-P180 WeakPolarHBondContact O-CA 3.27Å; W176-P180 WeakPolarHBondContact O-CB 3.41Å; W176-P180 WeakPolarHBondContact O-CD 3.21Å; W176-Y259 HydrophobicContact CH2-CE2 4.25Å
177	T	86.6	Confident	91	Very high	136 Å²	136	44.7 Å²	44.7	83%	0.834	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-22.6	-179.5	44.9	0	0	0	0	113.9	D175	D175-T177 PolarHBondContact O-N 3.46Å
178	A	87.7	Confident	90.6	Very high	79 Å²	79	46.9 Å²	46.9	65%	0.653	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-27.8	172	0	0	0	0	0	112	D175 W176	D175-A178 PolarHBondContact O-N 2.7Å; W176-A178 VanDerWaalsContact C-N 3.3Å; W176-A178 PolarHBondContact O-N 3.18Å
179	N	87.1	Confident	90.2	Very high	47 Å²	47	45.2 Å²	45.2	25%	0.251	24%	0.24	S	C	.	.			trans	-140.7	67	-168.8	-163.8	18.1	0	0	0	112.7	R172 D175 W176 R181	R172-N179 WeakPolarHBondContact CD-O 3.28Å; R172-N179 PolarHBondContact NE-ND2 3.33Å; D175-N179 PolarHBondContact O-N 3.05Å; D175-N179 WeakPolarHBondContact OD2-CB 3.23Å; W176-N179 CarbonylContact O-C 3.59Å; W176-N179 PolarHBondContact O-N 3.08Å; N179-R181 VanDerWaalsContact C-N 3.26Å; N179-R181 PolarHBondContact O-N 3.1Å; N179-R181 WeakPolarHBondContact OD1-CD 3.47Å; N179-R181 WeakPolarHBondContact OD1-CG 3.35Å
180	P	87.2	Confident	89.7	Confident	69 Å²	69	45.2 Å²	45.2	45%	0.448	24%	0.241	S	C	.	.			trans	-76.9	68.8	-172.8	32.3	-37.3	0	0	0	112.5	W176	W176-P180 HydrophobicContact CD2-CB 4.28Å; W176-P180 HydrophobicContact CG-CB 4.49Å; W176-P180 HydrophobicContact CZ2-CB 4.02Å; W176-P180 WeakPolarHBondContact O-CA 3.27Å; W176-P180 WeakPolarHBondContact O-CB 3.41Å; W176-P180 WeakPolarHBondContact O-CD 3.21Å
181	R	90.3	Very high	89.3	Confident	53 Å²	53	45.2 Å²	45.2	20%	0.2	25%	0.246	C	C	.	.			trans	-153.6	155.3	-175.9	52	168	-56.8	146.7	25.4	111.8	R172 N179 D184 D269 D272	R172-R181 WeakPolarHBondContact CD-O 3.41Å; R172-R181 WeakPolarHBondContact CG-O 3.39Å; R172-R181 PolarHBondContact NH1-O 2.96Å; N179-R181 VanDerWaalsContact C-N 3.26Å; N179-R181 PolarHBondContact O-N 3.1Å; N179-R181 WeakPolarHBondContact OD1-CD 3.47Å; N179-R181 WeakPolarHBondContact OD1-CG 3.35Å; R181-D184 IonicContact CZ-OD1 3.23Å; R181-D184 IonicContact NE-OD1 3.73Å; R181-D184 PolarHBondContact NE-OD1 3.42Å; R181-D184 IonicContact NH2-OD1 3.34Å; R181-D184 PolarHBondContact NH2-OD1 3.07Å; R181-D269 HydrophobicContact CB-CB 3.56Å; R181-D269 VanDerWaalsContact CB-CG 3.43Å; R181-D269 IonicContact CZ-OD1 2.7Å; R181-D269 IonicContact NE-OD1 2.67Å; R181-D269 PolarHBondContact NE-OD1 2.96Å; R181-D269 IonicContact NH2-OD1 3.78Å; R181-D269 PolarHBondContact NH2-OD1 3.17Å; R181-D272 IonicContact CZ-OD2 3.66Å; R181-D272 IonicContact NH1-OD2 2.78Å; R181-D272 PolarHBondContact NH1-OD2 3.16Å; R181-D272 VanDerWaalsContact NH2-CG 3.34Å; R181-D272 IonicContact NH2-OD2 3.3Å; R181-D272 PolarHBondContact NH2-OD2 2.88Å
182	I	92.9	Very high	88.9	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	24%	0.239	C	C	.	.			trans	-140.5	-18.1	178.8	-156.9	63.7	0	0	0	114.1	V107 L110 L169 R172 D184 V185 I186 Y259 D269	V107-I182 HydrophobicContact CG1-CB 4.43Å; V107-I182 HydrophobicContact CG1-CD1 3.74Å; V107-I182 HydrophobicContact CG1-CG1 3.96Å; V107-I182 HydrophobicContact CG2-CB 3.89Å; V107-I182 HydrophobicContact CG2-CG1 4.13Å; V107-I182 HydrophobicContact CG2-CG2 3.86Å; L110-I182 HydrophobicContact CD2-CG1 4.43Å; L169-I182 HydrophobicContact CD2-CD1 3.84Å; L169-I182 HydrophobicContact CD2-CG1 4.3Å; R172-I182 HydrophobicContact CB-CD1 4Å; R172-I182 HydrophobicContact CG-CD1 3.66Å; I182-D184 VanDerWaalsContact C-N 3.26Å; I182-D184 PolarHBondContact O-N 3.3Å; I182-V185 HydrophobicContact CD1-CB 4.11Å; I182-V185 HydrophobicContact CD1-CG2 4.14Å; I182-V185 WeakPolarHBondContact O-CA 3.4Å; I182-V185 WeakPolarHBondContact O-CB 3.39Å; I182-V185 PolarHBondContact O-N 3.49Å; I182-I186 HydrophobicContact CG1-CD1 4.05Å; I182-I186 HydrophobicContact CG1-CG1 4.2Å; I182-I186 HydrophobicContact CG2-CD1 3.87Å; I182-I186 PolarHBondContact O-N 3.09Å; I182-Y259 HydrophobicContact CG2-CD1 3.95Å; I182-Y259 HydrophobicContact CG2-CD2 4.37Å; I182-Y259 HydrophobicContact CG2-CE1 3.49Å; I182-Y259 VanDerWaalsContact CG2-CE1 3.49Å; I182-Y259 HydrophobicContact CG2-CE2 3.97Å; I182-Y259 HydrophobicContact CG2-CG 4.37Å; I182-D269 PolarHBondContact N-OD2 3.23Å
183	G	92.1	Very high	88.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-29.1	-176.3	0	0	0	0	0	114.4	Q187 D269	G183-Q187 WeakPolarHBondContact O-CB 3.49Å; G183-Q187 WeakPolarHBondContact O-CG 3.48Å; G183-Q187 PolarHBondContact O-N 3.05Å; G183-Q187 PolarHBondContact O-NE2 2.83Å; G183-D269 WeakPolarHBondContact CA-OD1 3.32Å; G183-D269 VanDerWaalsContact N-CG 3.28Å; G183-D269 PolarHBondContact N-OD1 2.92Å; G183-D269 PolarHBondContact N-OD2 3.39Å
184	D	91.7	Very high	87.9	Confident	32 Å²	32	46.3 Å²	46.3	17%	0.171	25%	0.253	C	S	.	.	H	α-helix	trans	-71.2	-30.6	171.1	65.2	-66.6	0	0	0	113	R172 R181 I182 K188	R172-D184 IonicContact CZ-OD1 3.94Å; R172-D184 IonicContact CZ-OD2 2.68Å; R172-D184 IonicContact NH1-OD1 3.79Å; R172-D184 PolarHBondContact NH1-OD1 2.79Å; R172-D184 IonicContact NH1-OD2 2.73Å; R172-D184 PolarHBondContact NH1-OD2 3.47Å; R172-D184 IonicContact NH2-OD1 3.19Å; R172-D184 IonicContact NH2-OD2 2.79Å; R172-D184 PolarHBondContact NH2-OD2 2.79Å; R181-D184 IonicContact CZ-OD1 3.23Å; R181-D184 IonicContact NE-OD1 3.73Å; R181-D184 PolarHBondContact NE-OD1 3.42Å; R181-D184 IonicContact NH2-OD1 3.34Å; R181-D184 PolarHBondContact NH2-OD1 3.07Å; I182-D184 VanDerWaalsContact C-N 3.26Å; I182-D184 PolarHBondContact O-N 3.3Å; D184-K188 WeakPolarHBondContact O-CE 3.35Å; D184-K188 VanDerWaalsContact O-CG 3.32Å; D184-K188 WeakPolarHBondContact O-CG 3.5Å; D184-K188 PolarHBondContact O-N 3.49Å; D184-K188 IonicContact OD2-NZ 2.62Å
185	V	92.5	Very high	87.5	Confident	1 Å²	1	42 Å²	42	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-71.6	-43.4	173.6	177.3	0	0	0	0	109.6	F165 E168 L169 R172 I182 K188 L189	F165-V185 HydrophobicContact CD2-CG1 4.33Å; F165-V185 HydrophobicContact CE2-CG1 4.1Å; E168-V185 HydrophobicContact CB-CG1 4.28Å; E168-V185 HydrophobicContact CG-CB 4.2Å; E168-V185 HydrophobicContact CG-CG1 3.51Å; E168-V185 HydrophobicContact CG-CG2 3.75Å; L169-V185 HydrophobicContact CD2-CG1 4.09Å; R172-V185 VanDerWaalsContact NH2-CG2 3.34Å; I182-V185 HydrophobicContact CD1-CB 4.11Å; I182-V185 HydrophobicContact CD1-CG2 4.14Å; I182-V185 WeakPolarHBondContact O-CA 3.4Å; I182-V185 WeakPolarHBondContact O-CB 3.39Å; I182-V185 PolarHBondContact O-N 3.49Å; V185-K188 WeakPolarHBondContact O-CB 3.48Å; V185-K188 PolarHBondContact O-N 2.82Å; V185-K188 VanDerWaalsContact O-N 3.09Å; V185-L189 PolarHBondContact O-N 3.41Å; V185-L189 VanDerWaalsContact O-N 3.1Å
186	I	89.9	Confident	87.2	Confident	9 Å²	9	39.2 Å²	39.2	5%	0.046	22%	0.215	C	C	.	.	H	α-helix	trans	-74.8	-27.8	-178.2	-53.4	173.9	0	0	0	111.4	L110 I182 K188 L189 A190 L256 A276 I280	L110-I186 HydrophobicContact CD2-CD1 3.84Å; L110-I186 HydrophobicContact CD2-CG1 4.45Å; I182-I186 HydrophobicContact CG1-CD1 4.05Å; I182-I186 HydrophobicContact CG1-CG1 4.2Å; I182-I186 HydrophobicContact CG2-CD1 3.87Å; I182-I186 PolarHBondContact O-N 3.09Å; I186-K188 VanDerWaalsContact C-N 3.31Å; I186-K188 PolarHBondContact O-N 2.71Å; I186-L189 HydrophobicContact CG2-CD2 4.19Å; I186-L189 WeakPolarHBondContact O-CB 3.26Å; I186-L189 PolarHBondContact O-N 2.84Å; I186-A190 PolarHBondContact O-N 2.91Å; I186-L256 HydrophobicContact CD1-CD1 3.98Å; I186-L256 HydrophobicContact CG2-CD2 4.06Å; I186-A276 HydrophobicContact CB-CB 3.96Å; I186-A276 HydrophobicContact CG2-CB 3.93Å; I186-I280 HydrophobicContact CG2-CD1 3.6Å
187	Q	89.8	Confident	86.6	Confident	30 Å²	30	41.2 Å²	41.2	14%	0.14	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-32.3	165.3	-89.9	179.7	89.3	0	0	113.4	G183 P191 D272 K275 A276 M279	G183-Q187 WeakPolarHBondContact O-CB 3.49Å; G183-Q187 WeakPolarHBondContact O-CG 3.48Å; G183-Q187 PolarHBondContact O-N 3.05Å; G183-Q187 PolarHBondContact O-NE2 2.83Å; Q187-P191 WeakPolarHBondContact O-CD 3.46Å; Q187-D272 VanDerWaalsContact NE2-CA 3.29Å; Q187-D272 VanDerWaalsContact NE2-CG 3.3Å; Q187-D272 PolarHBondContact NE2-O 2.96Å; Q187-D272 PolarHBondContact NE2-OD1 2.9Å; Q187-K275 HydrophobicContact CG-CG 4.49Å; Q187-K275 VanDerWaalsContact OE1-CD 3.3Å; Q187-A276 HydrophobicContact CG-CB 3.96Å; Q187-M279 HydrophobicContact CG-SD 4.16Å
188	K	86.6	Confident	86.6	Confident	107 Å²	107	40.1 Å²	40.1	47%	0.465	22%	0.215	S	C	.	.	H	α-helix	trans	-70.8	-35.3	171.9	-62.2	164.1	-156.4	177.4	0	111.2	E168 D184 V185 I186 F192	E168-K188 IonicContact OE1-NZ 3.7Å; E168-K188 PolarHBondContact OE1-NZ 2.89Å; D184-K188 WeakPolarHBondContact O-CE 3.35Å; D184-K188 VanDerWaalsContact O-CG 3.32Å; D184-K188 WeakPolarHBondContact O-CG 3.5Å; D184-K188 PolarHBondContact O-N 3.49Å; D184-K188 IonicContact OD2-NZ 2.62Å; V185-K188 WeakPolarHBondContact O-CB 3.48Å; V185-K188 PolarHBondContact O-N 2.82Å; V185-K188 VanDerWaalsContact O-N 3.09Å; I186-K188 VanDerWaalsContact C-N 3.31Å; I186-K188 PolarHBondContact O-N 2.71Å; K188-F192 WeakPolarHBondContact O-CD2 3.33Å; K188-F192 WeakPolarHBondContact O-CE2 3.48Å
189	L	85.5	Confident	86.5	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-63.7	-53.2	175.1	166.9	68.8	0	0	0	112.4	F160 F165 V185 I186 P191 F192 L193 Y252	F160-L189 HydrophobicContact CE1-CD1 3.29Å; F160-L189 HydrophobicContact CZ-CD1 3.53Å; F165-L189 HydrophobicContact CD1-CD1 4.36Å; F165-L189 HydrophobicContact CD2-CB 4.03Å; F165-L189 HydrophobicContact CD2-CD1 4.27Å; F165-L189 HydrophobicContact CD2-CD2 4.42Å; F165-L189 HydrophobicContact CD2-CG 4.47Å; F165-L189 HydrophobicContact CE1-CD2 4.06Å; F165-L189 HydrophobicContact CE2-CB 3.96Å; F165-L189 HydrophobicContact CE2-CD2 3.85Å; F165-L189 HydrophobicContact CE2-CG 4.32Å; F165-L189 HydrophobicContact CG-CD1 4.2Å; F165-L189 HydrophobicContact CZ-CD2 3.66Å; V185-L189 PolarHBondContact O-N 3.41Å; V185-L189 VanDerWaalsContact O-N 3.1Å; I186-L189 HydrophobicContact CG2-CD2 4.19Å; I186-L189 WeakPolarHBondContact O-CB 3.26Å; I186-L189 PolarHBondContact O-N 2.84Å; L189-P191 VanDerWaalsContact C-CD 3.41Å; L189-P191 VanDerWaalsContact O-N 3.13Å; L189-F192 PolarHBondContact O-N 3.23Å; L189-L193 HydrophobicContact CD1-CD2 3.83Å; L189-L193 HydrophobicContact CD1-CG 4.2Å; L189-L193 HydrophobicContact CD2-CD1 4.45Å; L189-L193 HydrophobicContact CG-CD1 4.33Å; L189-L193 HydrophobicContact CG-CD2 4.2Å; L189-L193 HydrophobicContact CG-CG 4.13Å; L189-Y252 HydrophobicContact CD2-CD1 4.46Å; L189-Y252 HydrophobicContact CD2-CD2 4.17Å; L189-Y252 HydrophobicContact CD2-CE1 4.46Å; L189-Y252 HydrophobicContact CD2-CE2 4.18Å; L189-Y252 HydrophobicContact CD2-CG 4.33Å
190	A	82.4	Confident	86.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.008	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-55	-36.8	-160.5	0	0	0	0	0	115.9	I186 F192 L193 M279 I280	I186-A190 PolarHBondContact O-N 2.91Å; A190-F192 VanDerWaalsContact C-N 3.29Å; A190-F192 PolarHBondContact O-N 2.77Å; A190-L193 PolarHBondContact O-N 3.1Å; A190-M279 HydrophobicContact CB-CB 3.55Å; A190-M279 HydrophobicContact CB-CE 4.24Å; A190-I280 HydrophobicContact CB-CG1 3.95Å
191	P	84.6	Confident	85.8	Confident	65 Å²	65	40.5 Å²	40.5	42%	0.422	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-59.1	-35.4	174.4	-25.7	35.8	0	0	0	114.2	Q187 L189 M279	Q187-P191 WeakPolarHBondContact O-CD 3.46Å; L189-P191 VanDerWaalsContact C-CD 3.41Å; L189-P191 VanDerWaalsContact O-N 3.13Å; P191-M279 HydrophobicContact CG-CE 3.69Å
192	F	84.9	Confident	85.5	Confident	61 Å²	61	39.3 Å²	39.3	27%	0.268	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-76	-22.2	-177.8	-62.9	-84.8	0	0	0	112.8	L15 F160 K188 L189 A190 K194 M195	L15-F192 HydrophobicContact CD1-CZ 4.32Å; L15-F192 HydrophobicContact CD2-CE1 4.36Å; F160-F192 HydrophobicContact CD2-CB 3.94Å; F160-F192 AromaticContact CD2-CD1 3.99Å; F160-F192 HydrophobicContact CD2-CD1 3.99Å; F160-F192 HydrophobicContact CD2-CD2 4.16Å; F160-F192 AromaticContact CD2-CG 3.76Å; F160-F192 HydrophobicContact CD2-CG 3.76Å; F160-F192 HydrophobicContact CE1-CB 4.41Å; F160-F192 HydrophobicContact CE2-CB 3.71Å; F160-F192 HydrophobicContact CE2-CD1 4.1Å; F160-F192 AromaticContact CE2-CD2 3.43Å; F160-F192 HydrophobicContact CE2-CD2 3.43Å; F160-F192 VanDerWaalsContact CE2-CD2 3.43Å; F160-F192 HydrophobicContact CE2-CE2 4.04Å; F160-F192 AromaticContact CE2-CG 3.47Å; F160-F192 HydrophobicContact CE2-CG 3.47Å; F160-F192 VanDerWaalsContact CE2-CG 3.47Å; F160-F192 HydrophobicContact CG-CB 4.38Å; F160-F192 HydrophobicContact CZ-CB 3.99Å; F160-F192 HydrophobicContact CZ-CD2 4.05Å; F160-F192 HydrophobicContact CZ-CG 4.17Å; K188-F192 WeakPolarHBondContact O-CD2 3.33Å; K188-F192 WeakPolarHBondContact O-CE2 3.48Å; L189-F192 PolarHBondContact O-N 3.23Å; A190-F192 VanDerWaalsContact C-N 3.29Å; A190-F192 PolarHBondContact O-N 2.77Å; F192-K194 PolarHBondContact O-N 3.41Å; F192-M195 WeakPolarHBondContact O-CG 3.46Å; F192-M195 PolarHBondContact O-N 3.06Å
193	L	81.4	Confident	84.9	Confident	3 Å²	3	41 Å²	41	2%	0.016	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-58.5	-19.2	176.3	-64.4	-179.5	0	0	0	113.1	L189 A190 M195 Y196 Y252 I280 A283	L189-L193 HydrophobicContact CD1-CD2 3.83Å; L189-L193 HydrophobicContact CD1-CG 4.2Å; L189-L193 HydrophobicContact CD2-CD1 4.45Å; L189-L193 HydrophobicContact CG-CD1 4.33Å; L189-L193 HydrophobicContact CG-CD2 4.2Å; L189-L193 HydrophobicContact CG-CG 4.13Å; A190-L193 PolarHBondContact O-N 3.1Å; L193-M195 PolarHBondContact O-N 3.44Å; L193-M195 VanDerWaalsContact O-N 3.13Å; L193-Y196 HydrophobicContact CD2-CD2 4.13Å; L193-Y196 HydrophobicContact CD2-CE2 3.69Å; L193-Y196 WeakPolarHBondContact O-CB 3.5Å; L193-Y196 WeakPolarHBondContact O-CD2 3.24Å; L193-Y196 PolarHBondContact O-N 3.24Å; L193-Y252 HydrophobicContact CD1-CD2 4.37Å; L193-Y252 HydrophobicContact CD2-CD2 4.25Å; L193-Y252 HydrophobicContact CD2-CE2 4.02Å; L193-I280 HydrophobicContact CD1-CB 4.34Å; L193-I280 HydrophobicContact CD1-CG1 3.75Å; L193-I280 HydrophobicContact CD1-CG2 4.17Å; L193-A283 HydrophobicContact CB-CB 4.02Å
194	K	80.3	Confident	84	Confident	100 Å²	100	48.3 Å²	48.3	44%	0.435	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-57.2	-23.8	171.7	-65.4	-170.2	175.4	-163.4	0	113.5	F192 Y196 S197 A283 H286	F192-K194 PolarHBondContact O-N 3.41Å; K194-Y196 PolarHBondContact O-N 2.81Å; K194-S197 WeakPolarHBondContact O-CB 3.34Å; K194-S197 PolarHBondContact O-N 3.03Å; K194-S197 PolarHBondContact O-OG 3.1Å; K194-A283 HydrophobicContact CG-CB 4.14Å; K194-H286 PolarHBondContact NZ-CD2 2.91Å; K194-H286 PolarHBondContact NZ-NE2 3.34Å
195	M	83.9	Confident	83.5	Confident	21 Å²	21	53.5 Å²	53.5	10%	0.103	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-64.3	-26.1	174.9	75	-166.8	161	0	0	113.3	N153 I157 F160 F192 L193 S197 E198	N153-M195 PolarHBondContact ND2-O 3.4Å; I157-M195 HydrophobicContact CB-CE 4.33Å; I157-M195 HydrophobicContact CG1-CE 4.1Å; I157-M195 HydrophobicContact CG1-CG 3.99Å; I157-M195 HydrophobicContact CG1-SD 4.05Å; I157-M195 HydrophobicContact CG2-CE 4.4Å; F160-M195 HydrophobicContact CB-CE 3.99Å; F160-M195 HydrophobicContact CB-SD 4.47Å; F160-M195 HydrophobicContact CD1-CE 3.71Å; F160-M195 HydrophobicContact CG-CE 3.95Å; F192-M195 WeakPolarHBondContact O-CG 3.46Å; F192-M195 PolarHBondContact O-N 3.06Å; L193-M195 PolarHBondContact O-N 3.44Å; L193-M195 VanDerWaalsContact O-N 3.13Å; M195-S197 PolarHBondContact O-N 2.93Å; M195-E198 PolarHBondContact O-N 3.1Å
196	Y	83.5	Confident	83.1	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-67.4	-20.5	177.3	-71.8	-108	0	0	0	112.4	Y117 I157 H161 L193 K194 E198 Y199 V200 P245 I249	Y117-Y196 WeakPolarHBondContact OH-CE1 3.18Å; Y117-Y196 PolarHBondContact OH-OH 2.96Å; I157-Y196 HydrophobicContact CD1-CD1 4.17Å; I157-Y196 HydrophobicContact CD1-CE1 4.27Å; I157-Y196 HydrophobicContact CD1-CG 4.38Å; I157-Y196 HydrophobicContact CG2-CE1 4.08Å; I157-Y196 HydrophobicContact CG2-CE2 4.23Å; I157-Y196 WeakPolarHBondContact CG2-OH 3.38Å; H161-Y196 PolarHBondContact CD2-OH 3.1Å; H161-Y196 VanDerWaalsContact CD2-OH 3.24Å; H161-Y196 AromaticContact NE2-CE2 3.77Å; H161-Y196 AromaticContact NE2-CZ 3.67Å; H161-Y196 PolarHBondContact NE2-OH 3.22Å; L193-Y196 HydrophobicContact CD2-CD2 4.13Å; L193-Y196 HydrophobicContact CD2-CE2 3.69Å; L193-Y196 WeakPolarHBondContact O-CB 3.5Å; L193-Y196 WeakPolarHBondContact O-CD2 3.24Å; L193-Y196 PolarHBondContact O-N 3.24Å; K194-Y196 PolarHBondContact O-N 2.81Å; Y196-E198 VanDerWaalsContact C-N 3.28Å; Y196-E198 PolarHBondContact O-N 3.24Å; Y196-Y199 PolarHBondContact O-N 3.26Å; Y196-V200 WeakPolarHBondContact O-CG2 3.18Å; Y196-V200 PolarHBondContact O-N 3.31Å; Y196-P245 HydrophobicContact CD1-CB 4.17Å; Y196-P245 WeakPolarHBondContact CD1-O 3.4Å; Y196-P245 HydrophobicContact CE1-CB 3.82Å; Y196-P245 WeakPolarHBondContact CE1-O 3.5Å; Y196-I249 HydrophobicContact CD1-CD1 3.84Å; Y196-I249 HydrophobicContact CD1-CG1 4.04Å; Y196-I249 HydrophobicContact CD2-CD1 4.41Å; Y196-I249 HydrophobicContact CE1-CG1 4.35Å; Y196-I249 HydrophobicContact CG-CD1 3.7Å; Y196-I249 HydrophobicContact CG-CG1 4.2Å
197	S	78.8	Confident	82.3	Confident	46 Å²	46	55 Å²	55	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-39.1	175.9	67	0	0	0	0	112.5	K194 M195 K201 S287	K194-S197 WeakPolarHBondContact O-CB 3.34Å; K194-S197 PolarHBondContact O-N 3.03Å; K194-S197 PolarHBondContact O-OG 3.1Å; M195-S197 PolarHBondContact O-N 2.93Å; S197-K201 WeakPolarHBondContact O-CB 3.33Å; S197-K201 PolarHBondContact O-N 3.18Å; S197-S287 WeakPolarHBondContact CB-OG 3.38Å
198	E	84.8	Confident	81.7	Confident	113 Å²	113	59.2 Å²	59.2	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-69.4	-43.7	176.3	175.2	178.8	-158.1	0	0	111.2	N153 M195 Y196 N202	N153-E198 PolarHBondContact ND2-OE2 3.19Å; M195-E198 PolarHBondContact O-N 3.1Å; Y196-E198 VanDerWaalsContact C-N 3.28Å; Y196-E198 PolarHBondContact O-N 3.24Å; E198-N202 WeakPolarHBondContact O-CB 3.2Å; E198-N202 PolarHBondContact O-N 3.12Å
199	Y	86.4	Confident	81.6	Confident	7 Å²	7	55.9 Å²	55.9	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-60.5	-52.6	177	-172.9	-93.3	0	0	0	112	I154 I157 Y196 N202 F203 M242 P245 V246	I154-Y199 HydrophobicContact CB-CE2 4.17Å; I154-Y199 HydrophobicContact CD1-CD2 4.44Å; I154-Y199 HydrophobicContact CD1-CE2 3.85Å; I154-Y199 HydrophobicContact CG1-CE2 4.44Å; I157-Y199 HydrophobicContact CD1-CD2 4.07Å; I157-Y199 HydrophobicContact CD1-CG 4.04Å; Y196-Y199 PolarHBondContact O-N 3.26Å; Y199-N202 PolarHBondContact O-N 3.06Å; Y199-F203 HydrophobicContact CE1-CD2 4.29Å; Y199-F203 PolarHBondContact O-N 3.38Å; Y199-F203 VanDerWaalsContact O-N 3.16Å; Y199-M242 WeakPolarHBondContact CE1-O 3.47Å; Y199-M242 WeakPolarHBondContact OH-CA 3.47Å; Y199-M242 WeakPolarHBondContact OH-CB 3.33Å; Y199-M242 PolarHBondContact OH-O 3.34Å; Y199-P245 HydrophobicContact CD1-CB 4.2Å; Y199-P245 HydrophobicContact CE1-CB 3.9Å; Y199-P245 HydrophobicContact CE1-CG 4.04Å; Y199-V246 HydrophobicContact CD1-CG2 4.37Å; Y199-V246 HydrophobicContact CE1-CG2 4.14Å
200	V	78.9	Confident	81.5	Confident	18 Å²	18	55.8 Å²	55.8	11%	0.109	27%	0.27	C	S	.	.	H	α-helix	trans	-66.5	-42.6	-178.5	-177.9	0	0	0	0	111	Y196 N202 F203 V246 A290	Y196-V200 WeakPolarHBondContact O-CG2 3.18Å; Y196-V200 PolarHBondContact O-N 3.31Å; V200-N202 PolarHBondContact O-N 3.12Å; V200-N202 VanDerWaalsContact O-N 3.13Å; V200-F203 VanDerWaalsContact O-CB 3.3Å; V200-F203 WeakPolarHBondContact O-CB 3.13Å; V200-F203 PolarHBondContact O-N 3.04Å; V200-V246 HydrophobicContact CG2-CG1 4.07Å; V200-V246 HydrophobicContact CG2-CG2 4.09Å; V200-A290 HydrophobicContact CB-CB 3.84Å; V200-A290 HydrophobicContact CG1-CB 3.43Å; V200-A290 VanDerWaalsContact CG1-CB 3.43Å
201	K	80.4	Confident	81.2	Confident	178 Å²	178	58.4 Å²	58.4	77%	0.774	29%	0.292	S	S	*	.	H	α-helix	trans	-58.5	-26.2	176	179.7	178.2	176.3	-175.9	0	113.1	S197	S197-K201 WeakPolarHBondContact O-CB 3.33Å; S197-K201 PolarHBondContact O-N 3.18Å
202	N	84.6	Confident	81.1	Confident	28 Å²	28	58.5 Å²	58.5	15%	0.15	29%	0.291	C	S	.	.	H	α-helix	trans	-95.6	-8.6	179.8	-177	85.6	0	0	0	113.3	V149 E198 Y199 V200 E204 R205 A206	V149-N202 PolarHBondContact O-ND2 3.46Å; E198-N202 WeakPolarHBondContact O-CB 3.2Å; E198-N202 PolarHBondContact O-N 3.12Å; Y199-N202 PolarHBondContact O-N 3.06Å; V200-N202 PolarHBondContact O-N 3.12Å; V200-N202 VanDerWaalsContact O-N 3.13Å; N202-E204 PolarHBondContact O-N 3.46Å; N202-R205 PolarHBondContact O-N 2.72Å; N202-A206 WeakPolarHBondContact O-CB 3.19Å; N202-A206 PolarHBondContact O-N 2.74Å
203	F	79.6	Confident	81.3	Confident	36 Å²	36	57.2 Å²	57.2	16%	0.158	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-43.2	-169.6	-173.7	-92.6	0	0	0	114	Y199 V200 A206 A207 M242 L243	Y199-F203 HydrophobicContact CE1-CD2 4.29Å; Y199-F203 PolarHBondContact O-N 3.38Å; Y199-F203 VanDerWaalsContact O-N 3.16Å; V200-F203 VanDerWaalsContact O-CB 3.3Å; V200-F203 WeakPolarHBondContact O-CB 3.13Å; V200-F203 PolarHBondContact O-N 3.04Å; F203-A206 WeakPolarHBondContact O-CB 3.22Å; F203-A206 PolarHBondContact O-N 2.73Å; F203-A207 PolarHBondContact O-N 3.02Å; F203-M242 HydrophobicContact CE2-CB 3.9Å; F203-L243 HydrophobicContact CE1-CD2 4.19Å; F203-L243 HydrophobicContact CE2-CD2 4.2Å; F203-L243 HydrophobicContact CZ-CD2 3.53Å; F203-L243 HydrophobicContact CZ-CG 4.29Å
204	E	73.1	Confident	81.4	Confident	154 Å²	154	58.8 Å²	58.8	72%	0.72	29%	0.294	S	S	*	.	H	α-helix	trans	-58.1	-56.1	176.9	-179.1	175.9	-138.9	0	0	111.3	N202 A206 A207 E208	N202-E204 PolarHBondContact O-N 3.46Å; E204-A206 PolarHBondContact O-N 3.24Å; E204-A207 WeakPolarHBondContact O-CB 3.32Å; E204-A207 PolarHBondContact O-N 3.08Å; E204-E208 PolarHBondContact O-N 3.39Å
205	R	82.1	Confident	81.6	Confident	141 Å²	141	62.4 Å²	62.4	53%	0.532	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-35.4	176.1	-173	-176.6	-176	-161.4	1.7	112.9	V149 N202 L209	V149-R205 HydrophobicContact CG1-CG 4.38Å; N202-R205 PolarHBondContact O-N 2.72Å; R205-L209 HydrophobicContact CG-CD1 4.29Å; R205-L209 WeakPolarHBondContact O-CB 3.22Å; R205-L209 WeakPolarHBondContact O-CG 3.26Å; R205-L209 PolarHBondContact O-N 2.93Å
206	A	83.4	Confident	81.9	Confident	2 Å²	2	68.1 Å²	68.1	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-66.6	-40	175.5	0	0	0	0	0	111.9	I150 N202 F203 E204 L210 M242	I150-A206 VanDerWaalsContact O-CB 3.27Å; I150-A206 WeakPolarHBondContact O-CB 3.4Å; N202-A206 WeakPolarHBondContact O-CB 3.19Å; N202-A206 PolarHBondContact O-N 2.74Å; F203-A206 WeakPolarHBondContact O-CB 3.22Å; F203-A206 PolarHBondContact O-N 2.73Å; E204-A206 PolarHBondContact O-N 3.24Å; A206-L210 WeakPolarHBondContact O-CB 3.49Å; A206-L210 PolarHBondContact O-N 3.19Å; A206-M242 HydrophobicContact CB-CE 3.88Å
207	A	74.3	Confident	82.3	Confident	39 Å²	39	68.3 Å²	68.3	32%	0.322	34%	0.338	S	S	.	.	H	α-helix	trans	-66.7	-42.3	175.1	0	0	0	0	0	112.2	F203 E204 L210 A211	F203-A207 PolarHBondContact O-N 3.02Å; E204-A207 WeakPolarHBondContact O-CB 3.32Å; E204-A207 PolarHBondContact O-N 3.08Å; A207-L210 PolarHBondContact O-N 2.95Å; A207-A211 PolarHBondContact O-N 3.2Å
208	E	77	Confident	83	Confident	120 Å²	120	70.9 Å²	70.9	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-57.8	-50.1	173.8	-66.9	-179	138.6	0	0	112.1	E204 A211 T212	E204-E208 PolarHBondContact O-N 3.39Å; E208-A211 PolarHBondContact O-N 3.46Å; E208-T212 WeakPolarHBondContact O-CB 3.38Å; E208-T212 PolarHBondContact O-N 3.34Å; E208-T212 PolarHBondContact O-OG1 2.98Å
209	L	82.9	Confident	83.3	Confident	36 Å²	36	68.1 Å²	68.1	19%	0.188	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-40.9	178	-75	170.7	0	0	0	111.7	V149 I150 R205 T212 W213	V149-L209 HydrophobicContact CB-CD1 3.9Å; V149-L209 HydrophobicContact CG1-CD1 3.43Å; V149-L209 VanDerWaalsContact CG1-CD1 3.43Å; I150-L209 HydrophobicContact CD1-CB 4.01Å; I150-L209 HydrophobicContact CG1-CB 3.66Å; I150-L209 HydrophobicContact CG1-CD1 4.46Å; R205-L209 HydrophobicContact CG-CD1 4.29Å; R205-L209 WeakPolarHBondContact O-CB 3.22Å; R205-L209 WeakPolarHBondContact O-CG 3.26Å; R205-L209 PolarHBondContact O-N 2.93Å; L209-T212 PolarHBondContact O-N 2.85Å; L209-W213 WeakPolarHBondContact O-CB 3.18Å; L209-W213 VanDerWaalsContact O-CD1 3.27Å; L209-W213 PolarHBondContact O-N 3.05Å
210	L	83.3	Confident	83.7	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-42.8	178	177.7	55.8	0	0	0	111.5	I150 A206 A207 T214 F220 L224 L238 Q239 M242	I150-L210 HydrophobicContact CD1-CB 4.32Å; I150-L210 HydrophobicContact CG2-CB 4.39Å; A206-L210 WeakPolarHBondContact O-CB 3.49Å; A206-L210 PolarHBondContact O-N 3.19Å; A207-L210 PolarHBondContact O-N 2.95Å; L210-T214 WeakPolarHBondContact O-CB 3.28Å; L210-T214 PolarHBondContact O-N 3.26Å; L210-T214 VanDerWaalsContact O-N 3.14Å; L210-T214 PolarHBondContact O-OG1 2.97Å; L210-F220 HydrophobicContact CD1-CE1 3.82Å; L210-F220 HydrophobicContact CD1-CZ 3.96Å; L210-L224 HydrophobicContact CD1-CD1 3.78Å; L210-L238 HydrophobicContact CD1-CD2 3.75Å; L210-L238 HydrophobicContact CD2-CB 4.27Å; L210-L238 HydrophobicContact CD2-CD2 3.93Å; L210-L238 HydrophobicContact CD2-CG 3.93Å; L210-Q239 HydrophobicContact CD2-CG 3.8Å; L210-M242 HydrophobicContact CD2-SD 3.94Å
211	A	77.3	Confident	84.3	Confident	56 Å²	56	71.5 Å²	71.5	46%	0.463	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-54.8	171.9	0	0	0	0	0	111.3	A207 E208 W213 T214 E215	A207-A211 PolarHBondContact O-N 3.2Å; E208-A211 PolarHBondContact O-N 3.46Å; A211-W213 VanDerWaalsContact C-N 3.31Å; A211-W213 PolarHBondContact O-N 2.98Å; A211-T214 PolarHBondContact O-N 3.07Å; A211-T214 VanDerWaalsContact O-N 3.13Å; A211-E215 PolarHBondContact O-N 2.87Å
212	T	83.1	Confident	84.9	Confident	67 Å²	67	68.4 Å²	68.4	41%	0.411	35%	0.346	S	S	.	.	H	α-helix	trans	-51.6	-46.1	-178.5	-57.8	0	0	0	0	112.6	E208 L209 K216	E208-T212 WeakPolarHBondContact O-CB 3.38Å; E208-T212 PolarHBondContact O-N 3.34Å; E208-T212 PolarHBondContact O-OG1 2.98Å; L209-T212 PolarHBondContact O-N 2.85Å; T212-K216 WeakPolarHBondContact O-CB 3.38Å; T212-K216 PolarHBondContact O-N 3.49Å
213	W	88.6	Confident	85.4	Confident	34 Å²	34	67.3 Å²	67.3	13%	0.129	34%	0.34	C	S	.	.	H	α-helix	trans	-85.3	-18.6	-176.1	-72.8	95.9	0	0	0	114.1	F142 P143 V146 L209 A211 K216 S217 F220	F142-W213 HydrophobicContact CB-CD2 4.22Å; F142-W213 HydrophobicContact CB-CE3 3.57Å; F142-W213 HydrophobicContact CB-CH2 4.34Å; F142-W213 HydrophobicContact CB-CZ3 3.64Å; P143-W213 HydrophobicContact CG-CZ2 4.5Å; V146-W213 HydrophobicContact CG1-CD2 4.28Å; V146-W213 HydrophobicContact CG1-CG 3.85Å; V146-W213 HydrophobicContact CG2-CZ2 4.07Å; L209-W213 WeakPolarHBondContact O-CB 3.18Å; L209-W213 VanDerWaalsContact O-CD1 3.27Å; L209-W213 PolarHBondContact O-N 3.05Å; A211-W213 VanDerWaalsContact C-N 3.31Å; A211-W213 PolarHBondContact O-N 2.98Å; W213-K216 HydrophobicContact CD2-CD 4.47Å; W213-K216 HydrophobicContact CE3-CB 4.39Å; W213-K216 HydrophobicContact CE3-CD 4.14Å; W213-K216 HydrophobicContact CE3-CG 4.31Å; W213-K216 HydrophobicContact CH2-CD 4.12Å; W213-K216 HydrophobicContact CZ2-CD 4.42Å; W213-K216 HydrophobicContact CZ3-CD 3.96Å; W213-K216 HydrophobicContact CZ3-CG 4.28Å; W213-S217 PolarHBondContact O-N 2.75Å; W213-S217 VanDerWaalsContact O-N 3.17Å; W213-F220 VanDerWaalsContact C-CD1 3.44Å; W213-F220 HydrophobicContact CB-CD1 4.05Å; W213-F220 HydrophobicContact CB-CD2 4.26Å; W213-F220 HydrophobicContact CB-CE1 3.92Å; W213-F220 HydrophobicContact CB-CE2 4.18Å; W213-F220 HydrophobicContact CB-CG 4.22Å; W213-F220 HydrophobicContact CB-CZ 4.01Å; W213-F220 WeakPolarHBondContact O-CD1 3.5Å
214	T	83.9	Confident	85.9	Confident	35 Å²	35	65.8 Å²	65.8	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-38.5	167.4	-58.5	0	0	0	0	111.3	L210 A211 Q221 L224	L210-T214 WeakPolarHBondContact O-CB 3.28Å; L210-T214 PolarHBondContact O-N 3.26Å; L210-T214 VanDerWaalsContact O-N 3.14Å; L210-T214 PolarHBondContact O-OG1 2.97Å; A211-T214 PolarHBondContact O-N 3.07Å; A211-T214 VanDerWaalsContact O-N 3.13Å; T214-Q221 HydrophobicContact CG2-CB 4.26Å; T214-Q221 HydrophobicContact CG2-CG 4.01Å; T214-L224 WeakPolarHBondContact OG1-CD1 3.43Å
215	E	83.3	Confident	86.6	Confident	177 Å²	177	62.2 Å²	62.2	83%	0.827	32%	0.322	S	S	*	.	H	α-helix	trans	-77.3	-45.4	174.8	-175.9	173.5	-161.2	0	0	112.1	A211 S217	A211-E215 PolarHBondContact O-N 2.87Å; E215-S217 PolarHBondContact O-N 3.17Å
216	K	89.5	Confident	87	Confident	140 Å²	140	60.8 Å²	60.8	61%	0.609	32%	0.317	S	S	*	.	H	α-helix	trans	-73.7	-21.6	-172.2	-175.5	173.6	179.4	176.6	0	115.1	T212 W213	T212-K216 WeakPolarHBondContact O-CB 3.38Å; T212-K216 PolarHBondContact O-N 3.49Å; W213-K216 HydrophobicContact CD2-CD 4.47Å; W213-K216 HydrophobicContact CE3-CB 4.39Å; W213-K216 HydrophobicContact CE3-CD 4.14Å; W213-K216 HydrophobicContact CE3-CG 4.31Å; W213-K216 HydrophobicContact CH2-CD 4.12Å; W213-K216 HydrophobicContact CZ2-CD 4.42Å; W213-K216 HydrophobicContact CZ3-CD 3.96Å; W213-K216 HydrophobicContact CZ3-CG 4.28Å
217	S	93.6	Very high	87.3	Confident	6 Å²	6	61.1 Å²	61.1	4%	0.042	32%	0.318	C	S	.	.			trans	-135.9	102.8	-171.5	-166.3	0	0	0	0	112.2	A141 W213 E215 L219 F220 Q221	A141-S217 PolarHBondContact O-OG 2.89Å; W213-S217 PolarHBondContact O-N 2.75Å; W213-S217 VanDerWaalsContact O-N 3.17Å; E215-S217 PolarHBondContact O-N 3.17Å; S217-L219 PolarHBondContact O-N 3.37Å; S217-L219 VanDerWaalsContact O-N 3.16Å; S217-F220 VanDerWaalsContact O-CB 3.31Å; S217-F220 WeakPolarHBondContact O-CB 3.2Å; S217-F220 PolarHBondContact O-N 3.47Å; S217-Q221 PolarHBondContact O-N 2.92Å; S217-Q221 VanDerWaalsContact O-N 3.09Å
218	P	92.6	Very high	87.8	Confident	100 Å²	100	61.4 Å²	61.4	65%	0.649	31%	0.313	S	S	*	.	H	α-helix	trans	-56	-34	179.6	-29.1	36.3	0	0	0	113.9	Q221 E222	P218-Q221 PolarHBondContact O-N 3.5Å; P218-E222 WeakPolarHBondContact O-CB 3.35Å; P218-E222 PolarHBondContact O-N 3.28Å
219	L	92.3	Very high	88	Confident	55 Å²	55	60.1 Å²	60.1	29%	0.288	32%	0.317	S	S	.	.	H	α-helix	trans	-68.3	-34.6	176.2	-179.2	64.1	0	0	0	112.5	S139 A141 S217 E222 V223	S139-L219 VanDerWaalsContact CB-CD2 3.41Å; S139-L219 WeakPolarHBondContact OG-CD2 3.38Å; A141-L219 HydrophobicContact CB-CB 4.5Å; A141-L219 HydrophobicContact CB-CD2 4.14Å; S217-L219 PolarHBondContact O-N 3.37Å; S217-L219 VanDerWaalsContact O-N 3.16Å; L219-E222 PolarHBondContact O-N 2.77Å; L219-V223 WeakPolarHBondContact O-CG2 3.22Å; L219-V223 PolarHBondContact O-N 3.1Å; L219-V223 VanDerWaalsContact O-N 3.07Å
220	F	93.2	Very high	88	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-45.9	174.9	-174.2	-87.2	0	0	0	110	L132 F142 I150 L210 W213 S217 E222 V223 L224	L132-F220 HydrophobicContact CD1-CE2 4.31Å; L132-F220 HydrophobicContact CD1-CZ 4.49Å; L132-F220 HydrophobicContact CD2-CD2 3.77Å; L132-F220 HydrophobicContact CD2-CE2 3.9Å; L132-F220 HydrophobicContact CD2-CG 4.25Å; F142-F220 HydrophobicContact CD1-CB 3.87Å; F142-F220 AromaticContact CD1-CD2 3.95Å; F142-F220 HydrophobicContact CD1-CD2 3.95Å; F142-F220 HydrophobicContact CD1-CG 4.4Å; F142-F220 AromaticContact CD2-CD2 3.78Å; F142-F220 HydrophobicContact CD2-CD2 3.78Å; F142-F220 HydrophobicContact CD2-CE2 4.3Å; F142-F220 HydrophobicContact CE1-CB 3.73Å; F142-F220 AromaticContact CE1-CD2 3.87Å; F142-F220 HydrophobicContact CE1-CD2 3.87Å; F142-F220 HydrophobicContact CE1-CG 4.3Å; F142-F220 AromaticContact CE2-CD2 3.67Å; F142-F220 HydrophobicContact CE2-CD2 3.67Å; F142-F220 HydrophobicContact CE2-CE2 4.24Å; F142-F220 AromaticContact CG-CD2 3.91Å; F142-F220 HydrophobicContact CG-CD2 3.91Å; F142-F220 HydrophobicContact CZ-CB 4.32Å; F142-F220 AromaticContact CZ-CD2 3.72Å; F142-F220 HydrophobicContact CZ-CD2 3.72Å; F142-F220 HydrophobicContact CZ-CG 4.48Å; I150-F220 HydrophobicContact CD1-CE2 4.25Å; I150-F220 HydrophobicContact CD1-CZ 3.78Å; L210-F220 HydrophobicContact CD1-CE1 3.82Å; L210-F220 HydrophobicContact CD1-CZ 3.96Å; W213-F220 VanDerWaalsContact C-CD1 3.44Å; W213-F220 HydrophobicContact CB-CD1 4.05Å; W213-F220 HydrophobicContact CB-CD2 4.26Å; W213-F220 HydrophobicContact CB-CE1 3.92Å; W213-F220 HydrophobicContact CB-CE2 4.18Å; W213-F220 HydrophobicContact CB-CG 4.22Å; W213-F220 HydrophobicContact CB-CZ 4.01Å; W213-F220 WeakPolarHBondContact O-CD1 3.5Å; S217-F220 VanDerWaalsContact O-CB 3.31Å; S217-F220 WeakPolarHBondContact O-CB 3.2Å; S217-F220 PolarHBondContact O-N 3.47Å; F220-E222 PolarHBondContact O-N 3.18Å; F220-V223 PolarHBondContact O-N 3.45Å; F220-L224 HydrophobicContact CD1-CD1 3.78Å; F220-L224 HydrophobicContact CD1-CG 4.39Å; F220-L224 HydrophobicContact CE1-CD1 3.53Å; F220-L224 HydrophobicContact CE1-CG 4.32Å; F220-L224 HydrophobicContact CZ-CD1 4.4Å; F220-L224 WeakPolarHBondContact O-CG 3.46Å; F220-L224 PolarHBondContact O-N 2.91Å
221	Q	92.7	Very high	87.5	Confident	97 Å²	97	69.3 Å²	69.3	45%	0.453	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-39.8	173.2	-171.5	-176	17	0	0	112.7	T214 S217 P218 T225	T214-Q221 HydrophobicContact CG2-CB 4.26Å; T214-Q221 HydrophobicContact CG2-CG 4.01Å; S217-Q221 PolarHBondContact O-N 2.92Å; S217-Q221 VanDerWaalsContact O-N 3.09Å; P218-Q221 PolarHBondContact O-N 3.5Å; Q221-T225 VanDerWaalsContact O-CB 3.23Å; Q221-T225 WeakPolarHBondContact O-CB 3.44Å; Q221-T225 PolarHBondContact O-N 3.18Å; Q221-T225 PolarHBondContact O-OG1 3.35Å
222	E	92.9	Very high	87.3	Confident	113 Å²	113	69.6 Å²	69.6	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-62	-51.1	176.9	-171.5	-157.4	140.6	0	0	110.9	P218 L219 F220 L224 T225 R226	P218-E222 WeakPolarHBondContact O-CB 3.35Å; P218-E222 PolarHBondContact O-N 3.28Å; L219-E222 PolarHBondContact O-N 2.77Å; F220-E222 PolarHBondContact O-N 3.18Å; E222-L224 VanDerWaalsContact C-N 3.35Å; E222-L224 PolarHBondContact O-N 2.73Å; E222-T225 PolarHBondContact O-N 2.9Å; E222-R226 WeakPolarHBondContact O-CB 3.31Å; E222-R226 PolarHBondContact O-N 3.04Å
223	V	93.7	Very high	86.6	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.024	35%	0.347	C	S	.	.	H	α-helix	trans	-60.4	-44	179.7	171.1	0	0	0	0	111.2	E131 L132 A135 L219 F220 I227	E131-V223 HydrophobicContact CB-CG1 3.99Å; L132-V223 HydrophobicContact CD2-CB 3.99Å; L132-V223 HydrophobicContact CD2-CG1 3.65Å; L132-V223 HydrophobicContact CG-CG1 4.02Å; A135-V223 HydrophobicContact CB-CG2 4.03Å; L219-V223 WeakPolarHBondContact O-CG2 3.22Å; L219-V223 PolarHBondContact O-N 3.1Å; L219-V223 VanDerWaalsContact O-N 3.07Å; F220-V223 PolarHBondContact O-N 3.45Å; V223-I227 HydrophobicContact CG1-CD1 3.86Å; V223-I227 WeakPolarHBondContact O-CD1 3.37Å; V223-I227 VanDerWaalsContact O-CG1 3.25Å; V223-I227 WeakPolarHBondContact O-CG1 3.37Å; V223-I227 PolarHBondContact O-N 3.18Å; V223-I227 VanDerWaalsContact O-N 3.12Å
224	L	90.4	Very high	85.6	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.021	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-54.8	174.2	-74.9	179.8	0	0	0	111.8	F128 L132 L210 T214 F220 E222 R226 I227 Q228 L238	F128-L224 HydrophobicContact CD1-CD2 3.98Å; F128-L224 HydrophobicContact CE1-CD2 4.05Å; L132-L224 HydrophobicContact CD1-CD2 3.98Å; L210-L224 HydrophobicContact CD1-CD1 3.78Å; T214-L224 WeakPolarHBondContact OG1-CD1 3.43Å; F220-L224 HydrophobicContact CD1-CD1 3.78Å; F220-L224 HydrophobicContact CD1-CG 4.39Å; F220-L224 HydrophobicContact CE1-CD1 3.53Å; F220-L224 HydrophobicContact CE1-CG 4.32Å; F220-L224 HydrophobicContact CZ-CD1 4.4Å; F220-L224 WeakPolarHBondContact O-CG 3.46Å; F220-L224 PolarHBondContact O-N 2.91Å; E222-L224 VanDerWaalsContact C-N 3.35Å; E222-L224 PolarHBondContact O-N 2.73Å; L224-R226 VanDerWaalsContact C-N 3.3Å; L224-R226 PolarHBondContact O-N 3.38Å; L224-I227 PolarHBondContact O-N 3.23Å; L224-I227 VanDerWaalsContact O-N 3.13Å; L224-Q228 WeakPolarHBondContact O-CB 2.88Å; L224-Q228 VanDerWaalsContact O-CG 3.28Å; L224-Q228 WeakPolarHBondContact O-CG 3.44Å; L224-Q228 PolarHBondContact O-N 3.31Å; L224-L238 HydrophobicContact CD2-CB 4.11Å; L224-L238 HydrophobicContact CD2-CD2 3.55Å; L224-L238 HydrophobicContact CD2-CG 4.47Å
225	T	88.1	Confident	84.7	Confident	79 Å²	79	68.9 Å²	68.9	49%	0.485	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-42.5	-176.7	-59.3	0	0	0	0	111.5	Q221 E222 Q228 S229	Q221-T225 VanDerWaalsContact O-CB 3.23Å; Q221-T225 WeakPolarHBondContact O-CB 3.44Å; Q221-T225 PolarHBondContact O-N 3.18Å; Q221-T225 PolarHBondContact O-OG1 3.35Å; E222-T225 PolarHBondContact O-N 2.9Å; T225-Q228 PolarHBondContact O-N 2.94Å; T225-S229 WeakPolarHBondContact O-CB 3.28Å; T225-S229 PolarHBondContact O-N 3.15Å
226	R	91.9	Very high	83.7	Confident	111 Å²	111	61.8 Å²	61.8	42%	0.419	34%	0.343	S	S	.	.	H	α-helix	trans	-58.3	-48.5	174.9	-174.3	-169.7	71.2	-174.9	8.1	111.7	E131 E222 L224 S229	E131-R226 IonicContact OE2-CZ 3.8Å; E131-R226 IonicContact OE2-NH2 2.74Å; E131-R226 PolarHBondContact OE2-NH2 3.29Å; E222-R226 WeakPolarHBondContact O-CB 3.31Å; E222-R226 PolarHBondContact O-N 3.04Å; L224-R226 VanDerWaalsContact C-N 3.3Å; L224-R226 PolarHBondContact O-N 3.38Å; R226-S229 PolarHBondContact O-N 2.72Å; R226-S229 PolarHBondContact O-OG 3.38Å
227	I	88.3	Confident	82.9	Confident	9 Å²	9	57 Å²	57	5%	0.046	33%	0.325	C	S	.	.	H	α-helix	trans	-69.4	-41.8	179.4	-62.1	164.3	0	0	0	110.9	V127 F128 E131 V223 L224 S229 S230 S233	V127-I227 HydrophobicContact CG1-CD1 4.33Å; V127-I227 HydrophobicContact CG1-CG1 4.3Å; V127-I227 HydrophobicContact CG1-CG2 3.78Å; F128-I227 HydrophobicContact CD1-CB 4.06Å; F128-I227 HydrophobicContact CD1-CD1 3.91Å; F128-I227 HydrophobicContact CD1-CG2 3.74Å; F128-I227 HydrophobicContact CD2-CG2 4.08Å; F128-I227 HydrophobicContact CE1-CB 3.71Å; F128-I227 HydrophobicContact CE1-CD1 4.41Å; F128-I227 HydrophobicContact CE1-CG2 3.46Å; F128-I227 VanDerWaalsContact CE1-CG2 3.46Å; F128-I227 HydrophobicContact CE2-CG2 3.82Å; F128-I227 HydrophobicContact CG-CD1 4.49Å; F128-I227 HydrophobicContact CG-CG2 4.04Å; F128-I227 HydrophobicContact CZ-CB 4.17Å; F128-I227 HydrophobicContact CZ-CG2 3.51Å; E131-I227 HydrophobicContact CB-CD1 3.76Å; E131-I227 HydrophobicContact CG-CD1 4.01Å; V223-I227 HydrophobicContact CG1-CD1 3.86Å; V223-I227 WeakPolarHBondContact O-CD1 3.37Å; V223-I227 VanDerWaalsContact O-CG1 3.25Å; V223-I227 WeakPolarHBondContact O-CG1 3.37Å; V223-I227 PolarHBondContact O-N 3.18Å; V223-I227 VanDerWaalsContact O-N 3.12Å; L224-I227 PolarHBondContact O-N 3.23Å; L224-I227 VanDerWaalsContact O-N 3.13Å; I227-S229 PolarHBondContact O-N 3.42Å; I227-S230 VanDerWaalsContact O-CB 3.27Å; I227-S230 WeakPolarHBondContact O-CB 3.48Å; I227-S230 PolarHBondContact O-N 3.17Å; I227-S230 PolarHBondContact O-OG 3.39Å; I227-S233 WeakPolarHBondContact O-CB 3.35Å
228	Q	84.9	Confident	82.2	Confident	45 Å²	45	56.7 Å²	56.7	21%	0.21	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-31.9	176.5	-72.5	173.7	-127.6	0	0	113	F128 L224 T225 S230	F128-Q228 HydrophobicContact CE1-CG 4.2Å; F128-Q228 HydrophobicContact CZ-CG 4.06Å; L224-Q228 WeakPolarHBondContact O-CB 2.88Å; L224-Q228 VanDerWaalsContact O-CG 3.28Å; L224-Q228 WeakPolarHBondContact O-CG 3.44Å; L224-Q228 PolarHBondContact O-N 3.31Å; T225-Q228 PolarHBondContact O-N 2.94Å; Q228-S230 PolarHBondContact O-N 3.23Å
229	S	81.6	Confident	81.3	Confident	93 Å²	93	55.5 Å²	55.5	65%	0.65	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.1	175.2	78.5	0	0	0	0	114.4	T225 R226 I227	T225-S229 WeakPolarHBondContact O-CB 3.28Å; T225-S229 PolarHBondContact O-N 3.15Å; R226-S229 PolarHBondContact O-N 2.72Å; R226-S229 PolarHBondContact O-OG 3.38Å; I227-S229 PolarHBondContact O-N 3.42Å
230	S	81.9	Confident	80.1	Confident	40 Å²	40	56.5 Å²	56.5	28%	0.28	31%	0.312	S	S	.	.	S	Bend	trans	-76.9	148.1	178.3	75.7	0	0	0	0	112.6	I227 Q228 A232 S233	I227-S230 VanDerWaalsContact O-CB 3.27Å; I227-S230 WeakPolarHBondContact O-CB 3.48Å; I227-S230 PolarHBondContact O-N 3.17Å; I227-S230 PolarHBondContact O-OG 3.39Å; Q228-S230 PolarHBondContact O-N 3.23Å; S230-A232 PolarHBondContact O-N 2.91Å; S230-S233 PolarHBondContact O-N 3.39Å; S230-S233 VanDerWaalsContact O-N 3.08Å; S230-S233 PolarHBondContact OG-N 3.13Å
231	E	74.5	Confident	79.3	Confident	191 Å²	191	56.6 Å²	56.6	89%	0.893	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-57.8	-36.7	176.3	-174.1	171.8	-160.9	0	0	112.3	S233 G234	E231-S233 VanDerWaalsContact C-N 3.26Å; E231-S233 PolarHBondContact O-N 3.14Å; E231-G234 PolarHBondContact O-N 3.04Å
232	A	71.6	Confident	78.7	Confident	62 Å²	62	52.1 Å²	52.1	51%	0.512	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-58.4	-35.6	176.5	0	0	0	0	0	113	R120 L123 S230 G234	R120-A232 PolarHBondContact NH1-O 3.32Å; L123-A232 HydrophobicContact CD1-CB 4.31Å; S230-A232 PolarHBondContact O-N 2.91Å; A232-G234 VanDerWaalsContact C-N 3.26Å; A232-G234 PolarHBondContact O-N 3.1Å
233	S	70	Confident	77.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-75.7	-11.6	176.1	-162.2	0	0	0	0	113.6	I227 S230 E231 S235 L236 H241	I227-S233 WeakPolarHBondContact O-CB 3.35Å; S230-S233 PolarHBondContact O-N 3.39Å; S230-S233 VanDerWaalsContact O-N 3.08Å; S230-S233 PolarHBondContact OG-N 3.13Å; E231-S233 VanDerWaalsContact C-N 3.26Å; E231-S233 PolarHBondContact O-N 3.14Å; S233-S235 PolarHBondContact O-N 3.48Å; S233-L236 WeakPolarHBondContact O-CB 3.5Å; S233-L236 PolarHBondContact O-N 3.38Å; S233-L236 PolarHBondContact OG-O 2.87Å; S233-H241 PolarHBondContact O-CE1 2.91Å; S233-H241 VanDerWaalsContact O-CE1 3.26Å; S233-H241 PolarHBondContact O-NE2 3.33Å; S233-H241 VanDerWaalsContact O-NE2 3.12Å; S233-H241 PolarHBondContact OG-NE2 2.64Å
234	G	67.3	Low	76.7	Confident	30 Å²	30	49.3 Å²	49.3	31%	0.309	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	23.6	-178.6	0	0	0	0	0	114	E231 A232 L236	E231-G234 PolarHBondContact O-N 3.04Å; A232-G234 VanDerWaalsContact C-N 3.26Å; A232-G234 PolarHBondContact O-N 3.1Å; G234-L236 PolarHBondContact O-N 3.29Å
235	S	64.8	Low	76.4	Confident	91 Å²	91	49.1 Å²	49.1	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	10.9	-169	-52.2	0	0	0	0	116.1	S233	S233-S235 PolarHBondContact O-N 3.48Å
236	L	62.2	Low	75.7	Confident	28 Å²	28	45.7 Å²	45.7	15%	0.147	26%	0.257	C	S	.	.			trans	-80.5	154.4	174.9	-63.5	173	0	0	0	111.6	V68 Y72 S233 G234 H240	V68-L236 HydrophobicContact CG2-CD2 3.77Å; Y72-L236 HydrophobicContact CE1-CD1 4.44Å; S233-L236 WeakPolarHBondContact O-CB 3.5Å; S233-L236 PolarHBondContact O-N 3.38Å; S233-L236 PolarHBondContact OG-O 2.87Å; G234-L236 PolarHBondContact O-N 3.29Å; L236-H240 HydrophobicContact CB-CB 4.17Å
237	T	71.8	Confident	74.4	Confident	39 Å²	39	43.7 Å²	43.7	24%	0.239	25%	0.252	C	S	.	.			trans	-80	163.6	175.6	86.2	0	0	0	0	112.1	Q239 H240 H241	T237-Q239 VanDerWaalsContact C-N 3.31Å; T237-Q239 VanDerWaalsContact CB-OE1 3.31Å; T237-Q239 PolarHBondContact O-N 2.71Å; T237-Q239 PolarHBondContact OG1-N 3.39Å; T237-Q239 PolarHBondContact OG1-OE1 3.4Å; T237-H240 WeakPolarHBondContact O-CB 3.31Å; T237-H240 PolarHBondContact O-N 3.44Å; T237-H240 VanDerWaalsContact O-N 3.12Å; T237-H240 PolarHBondContact OG1-ND1 2.75Å; T237-H241 PolarHBondContact O-CD2 3.44Å; T237-H241 VanDerWaalsContact O-CD2 3.26Å; T237-H241 PolarHBondContact O-N 2.95Å
238	L	78.8	Confident	74	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.3	-41.7	175.4	174.6	57.1	0	0	0	112.2	L124 F128 L132 F151 L210 L224 H240 H241 M242	L124-L238 HydrophobicContact CD2-CD1 3.67Å; F128-L238 HydrophobicContact CB-CD1 4.06Å; F128-L238 HydrophobicContact CD1-CB 4.33Å; F128-L238 HydrophobicContact CD1-CD1 4.09Å; F128-L238 HydrophobicContact CD1-CD2 4.31Å; F128-L238 HydrophobicContact CD1-CG 4.47Å; F128-L238 HydrophobicContact CD2-CD1 3.93Å; F128-L238 HydrophobicContact CE1-CB 4.04Å; F128-L238 HydrophobicContact CE1-CD1 4.48Å; F128-L238 HydrophobicContact CE2-CD1 4.34Å; F128-L238 HydrophobicContact CG-CD1 3.8Å; F128-L238 HydrophobicContact CZ-CB 4.27Å; L132-L238 HydrophobicContact CD1-CD2 4.45Å; F151-L238 HydrophobicContact CE1-CD1 3.76Å; F151-L238 HydrophobicContact CE1-CD2 4.29Å; F151-L238 HydrophobicContact CE2-CD2 4.21Å; F151-L238 HydrophobicContact CZ-CD1 3.81Å; F151-L238 HydrophobicContact CZ-CD2 3.53Å; F151-L238 HydrophobicContact CZ-CG 4.3Å; L210-L238 HydrophobicContact CD1-CD2 3.75Å; L210-L238 HydrophobicContact CD2-CB 4.27Å; L210-L238 HydrophobicContact CD2-CD2 3.93Å; L210-L238 HydrophobicContact CD2-CG 3.93Å; L224-L238 HydrophobicContact CD2-CB 4.11Å; L224-L238 HydrophobicContact CD2-CD2 3.55Å; L224-L238 HydrophobicContact CD2-CG 4.47Å; L238-H240 PolarHBondContact O-N 2.85Å; L238-H241 PolarHBondContact O-N 2.9Å; L238-M242 HydrophobicContact CD1-CG 3.82Å; L238-M242 HydrophobicContact CD1-SD 3.91Å; L238-M242 HydrophobicContact CD2-SD 4.31Å; L238-M242 HydrophobicContact CG-CG 4.21Å; L238-M242 HydrophobicContact CG-SD 3.71Å; L238-M242 VanDerWaalsContact O-CG 3.3Å; L238-M242 WeakPolarHBondContact O-CG 3.3Å; L238-M242 PolarHBondContact O-N 2.89Å
239	Q	75	Confident	73.6	Confident	74 Å²	74	42 Å²	42	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-52.6	-41.4	175	-64.4	81.4	-3.7	0	0	112	L210 T237 M242	L210-Q239 HydrophobicContact CD2-CG 3.8Å; T237-Q239 VanDerWaalsContact C-N 3.31Å; T237-Q239 VanDerWaalsContact CB-OE1 3.31Å; T237-Q239 PolarHBondContact O-N 2.71Å; T237-Q239 PolarHBondContact OG1-N 3.39Å; T237-Q239 PolarHBondContact OG1-OE1 3.4Å; Q239-M242 PolarHBondContact O-N 3.37Å
240	H	66	Low	72.8	Confident	76 Å²	76	39.2 Å²	39.2	35%	0.352	22%	0.224	S	C	.	.	H	α-helix	trans	-67.5	-44.7	-179	-69.8	77.3	0	0	0	111.9	L236 T237 L238 M242 L243	L236-H240 HydrophobicContact CB-CB 4.17Å; T237-H240 WeakPolarHBondContact O-CB 3.31Å; T237-H240 PolarHBondContact O-N 3.44Å; T237-H240 VanDerWaalsContact O-N 3.12Å; T237-H240 PolarHBondContact OG1-ND1 2.75Å; L238-H240 PolarHBondContact O-N 2.85Å; H240-M242 VanDerWaalsContact C-N 3.31Å; H240-M242 PolarHBondContact O-N 3Å; H240-L243 WeakPolarHBondContact O-CB 3.41Å; H240-L243 PolarHBondContact O-N 2.74Å
241	H	76.8	Confident	72.1	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.009	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-36.4	177.3	-65.6	-67.1	0	0	0	111.8	L123 L124 F128 S233 T237 L238 L243 E244	L123-H241 WeakPolarHBondContact CD2-CE1 3.29Å; L124-H241 HydrophobicContact CD2-CB 3.65Å; L124-H241 HydrophobicContact CG-CB 4.14Å; F128-H241 AromaticContact CE2-CD2 3.77Å; S233-H241 PolarHBondContact O-CE1 2.91Å; S233-H241 VanDerWaalsContact O-CE1 3.26Å; S233-H241 PolarHBondContact O-NE2 3.33Å; S233-H241 VanDerWaalsContact O-NE2 3.12Å; S233-H241 PolarHBondContact OG-NE2 2.64Å; T237-H241 PolarHBondContact O-CD2 3.44Å; T237-H241 VanDerWaalsContact O-CD2 3.26Å; T237-H241 PolarHBondContact O-N 2.95Å; L238-H241 PolarHBondContact O-N 2.9Å; H241-L243 PolarHBondContact O-N 2.85Å; H241-E244 PolarHBondContact O-N 3.21Å; H241-E244 VanDerWaalsContact O-N 3.12Å
242	M	80.9	Confident	72.3	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.02	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.7	-180	-72.4	173.4	68.2	0	0	114.1	L124 I150 Y199 F203 A206 L210 L238 Q239 H240 P245	L124-M242 HydrophobicContact CD2-CG 3.78Å; I150-M242 HydrophobicContact CG2-CE 4.16Å; I150-M242 HydrophobicContact CG2-SD 4.37Å; I150-M242 WeakPolarHBondContact O-CE 3.27Å; Y199-M242 WeakPolarHBondContact CE1-O 3.47Å; Y199-M242 WeakPolarHBondContact OH-CA 3.47Å; Y199-M242 WeakPolarHBondContact OH-CB 3.33Å; Y199-M242 PolarHBondContact OH-O 3.34Å; F203-M242 HydrophobicContact CE2-CB 3.9Å; A206-M242 HydrophobicContact CB-CE 3.88Å; L210-M242 HydrophobicContact CD2-SD 3.94Å; L238-M242 HydrophobicContact CD1-CG 3.82Å; L238-M242 HydrophobicContact CD1-SD 3.91Å; L238-M242 HydrophobicContact CD2-SD 4.31Å; L238-M242 HydrophobicContact CG-CG 4.21Å; L238-M242 HydrophobicContact CG-SD 3.71Å; L238-M242 VanDerWaalsContact O-CG 3.3Å; L238-M242 WeakPolarHBondContact O-CG 3.3Å; L238-M242 PolarHBondContact O-N 2.89Å; Q239-M242 PolarHBondContact O-N 3.37Å; H240-M242 VanDerWaalsContact C-N 3.31Å; H240-M242 PolarHBondContact O-N 3Å; M242-P245 WeakPolarHBondContact O-CD 3.22Å
243	L	69.9	Low	72.4	Confident	14 Å²	14	29.4 Å²	29.4	7%	0.073	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-29.1	175.1	-60.3	160.8	0	0	0	113.7	F203 H240 H241 P245 V246 Q247 P316	F203-L243 HydrophobicContact CE1-CD2 4.19Å; F203-L243 HydrophobicContact CE2-CD2 4.2Å; F203-L243 HydrophobicContact CZ-CD2 3.53Å; F203-L243 HydrophobicContact CZ-CG 4.29Å; H240-L243 WeakPolarHBondContact O-CB 3.41Å; H240-L243 PolarHBondContact O-N 2.74Å; H241-L243 PolarHBondContact O-N 2.85Å; L243-P245 VanDerWaalsContact C-CD 3.42Å; L243-P245 VanDerWaalsContact C-N 3.3Å; L243-V246 WeakPolarHBondContact O-CB 3.15Å; L243-V246 PolarHBondContact O-N 3.45Å; L243-Q247 WeakPolarHBondContact O-CG 3.09Å; L243-Q247 PolarHBondContact O-N 3.32Å; L243-P316 HydrophobicContact CD1-CB 4.49Å; L243-P316 HydrophobicContact CD1-CG 3.32Å; L243-P316 HydrophobicContact CD2-CB 3.83Å; L243-P316 HydrophobicContact CD2-CG 3.47Å; L243-P316 VanDerWaalsContact CD2-CG 3.47Å; L243-P316 HydrophobicContact CG-CG 3.97Å
244	E	74.2	Confident	72.3	Confident	44 Å²	44	34.8 Å²	34.8	21%	0.206	19%	0.189	C	C	.	.	H	α-helix	trans	-55.9	-36.8	-173.1	-71.2	-83.4	-145	0	0	113.2	Y117 H241 Q247 R248 R251	Y117-E244 HydrophobicContact CE2-CB 4.43Å; H241-E244 PolarHBondContact O-N 3.21Å; H241-E244 VanDerWaalsContact O-N 3.12Å; E244-Q247 PolarHBondContact O-N 3.04Å; E244-R248 PolarHBondContact O-N 3.34Å; E244-R251 IonicContact OE2-CZ 3.08Å; E244-R251 IonicContact OE2-NH1 2.7Å; E244-R251 PolarHBondContact OE2-NH1 3.26Å; E244-R251 IonicContact OE2-NH2 3.76Å; E244-R251 PolarHBondContact OE2-NH2 3.13Å
245	P	83.6	Confident	72.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-43.2	172.4	-23.2	34.6	0	0	0	113.6	Y117 L121 L124 I154 Y196 Y199 M242 L243 Q247 R248	Y117-P245 WeakPolarHBondContact OH-CA 3.41Å; L121-P245 HydrophobicContact CD2-CG 3.99Å; L124-P245 HydrophobicContact CD1-CG 4.16Å; I154-P245 HydrophobicContact CD1-CG 3.74Å; Y196-P245 HydrophobicContact CD1-CB 4.17Å; Y196-P245 WeakPolarHBondContact CD1-O 3.4Å; Y196-P245 HydrophobicContact CE1-CB 3.82Å; Y196-P245 WeakPolarHBondContact CE1-O 3.5Å; Y199-P245 HydrophobicContact CD1-CB 4.2Å; Y199-P245 HydrophobicContact CE1-CB 3.9Å; Y199-P245 HydrophobicContact CE1-CG 4.04Å; M242-P245 WeakPolarHBondContact O-CD 3.22Å; L243-P245 VanDerWaalsContact C-CD 3.42Å; L243-P245 VanDerWaalsContact C-N 3.3Å; P245-Q247 VanDerWaalsContact C-N 3.33Å; P245-Q247 PolarHBondContact O-N 2.92Å; P245-R248 PolarHBondContact O-N 2.98Å
246	V	74.4	Confident	73.5	Confident	7 Å²	7	30.2 Å²	30.2	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-46.2	176.7	-165.9	0	0	0	0	109.6	Y199 V200 L243 R248 P250 M294 L297	Y199-V246 HydrophobicContact CD1-CG2 4.37Å; Y199-V246 HydrophobicContact CE1-CG2 4.14Å; V200-V246 HydrophobicContact CG2-CG1 4.07Å; V200-V246 HydrophobicContact CG2-CG2 4.09Å; L243-V246 WeakPolarHBondContact O-CB 3.15Å; L243-V246 PolarHBondContact O-N 3.45Å; V246-R248 VanDerWaalsContact C-N 3.26Å; V246-R248 PolarHBondContact O-N 2.67Å; V246-P250 WeakPolarHBondContact O-CD 3.33Å; V246-M294 HydrophobicContact CG1-CE 4.12Å; V246-L297 HydrophobicContact CG1-CD1 4.23Å
247	Q	63.3	Low	74.2	Confident	68 Å²	68	32.9 Å²	32.9	32%	0.318	16%	0.16	S	C	.	.	H	α-helix	trans	-70.3	-14.5	-179.1	-63.8	-178.9	7.3	0	0	114.3	L243 E244 P245 R251	L243-Q247 WeakPolarHBondContact O-CG 3.09Å; L243-Q247 PolarHBondContact O-N 3.32Å; E244-Q247 PolarHBondContact O-N 3.04Å; P245-Q247 VanDerWaalsContact C-N 3.33Å; P245-Q247 PolarHBondContact O-N 2.92Å; Q247-R251 WeakPolarHBondContact O-CD 3.49Å; Q247-R251 VanDerWaalsContact O-CG 3.24Å; Q247-R251 WeakPolarHBondContact O-CG 3.48Å; Q247-R251 PolarHBondContact O-NE 3.27Å
248	R	81.6	Confident	74.4	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-76.5	-32.5	-178.5	-167.3	71.4	177.7	147.9	-1.3	113.1	L110 T113 E114 Y117 E244 P245 V246 R251 Y252	L110-R248 PolarHBondContact O-NH2 3.27Å; T113-R248 VanDerWaalsContact CB-NH1 3.31Å; T113-R248 PolarHBondContact OG1-NH1 3.48Å; T113-R248 PolarHBondContact OG1-NH2 2.99Å; E114-R248 IonicContact OE2-CZ 3.33Å; E114-R248 VanDerWaalsContact OE2-CZ 3.28Å; E114-R248 IonicContact OE2-NE 2.75Å; E114-R248 PolarHBondContact OE2-NE 3.21Å; E114-R248 VanDerWaalsContact OE2-NE 3.1Å; E114-R248 IonicContact OE2-NH2 2.75Å; E114-R248 PolarHBondContact OE2-NH2 3.29Å; Y117-R248 HydrophobicContact CD1-CB 4.47Å; Y117-R248 HydrophobicContact CD1-CG 3.7Å; Y117-R248 HydrophobicContact CD2-CB 4.27Å; Y117-R248 HydrophobicContact CD2-CG 4.22Å; Y117-R248 HydrophobicContact CE1-CB 4.06Å; Y117-R248 HydrophobicContact CE1-CG 3.59Å; Y117-R248 HydrophobicContact CE2-CB 3.86Å; Y117-R248 HydrophobicContact CE2-CG 4.14Å; Y117-R248 HydrophobicContact CG-CG 4.02Å; E244-R248 PolarHBondContact O-N 3.34Å; P245-R248 PolarHBondContact O-N 2.98Å; V246-R248 VanDerWaalsContact C-N 3.26Å; V246-R248 PolarHBondContact O-N 2.67Å; R248-R251 WeakPolarHBondContact O-CB 3.38Å; R248-R251 PolarHBondContact O-N 2.75Å; R248-Y252 HydrophobicContact CB-CE2 4.48Å; R248-Y252 HydrophobicContact CG-CD2 4.32Å; R248-Y252 HydrophobicContact CG-CE1 4.09Å; R248-Y252 HydrophobicContact CG-CE2 3.55Å; R248-Y252 VanDerWaalsContact CG-OH 3.26Å; R248-Y252 WeakPolarHBondContact CG-OH 3.46Å; R248-Y252 PolarHBondContact NE-OH 2.98Å; R248-Y252 WeakPolarHBondContact O-CD2 3.2Å; R248-Y252 PolarHBondContact O-N 2.98Å; R248-Y252 VanDerWaalsContact O-N 3.15Å
249	I	75.9	Confident	74.7	Confident	14 Å²	14	34.8 Å²	34.8	7%	0.072	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-49.4	-176.2	-50	173.4	0	0	0	112.1	Y196 R251 Y252 E253 I280	Y196-I249 HydrophobicContact CD1-CD1 3.84Å; Y196-I249 HydrophobicContact CD1-CG1 4.04Å; Y196-I249 HydrophobicContact CD2-CD1 4.41Å; Y196-I249 HydrophobicContact CE1-CG1 4.35Å; Y196-I249 HydrophobicContact CG-CD1 3.7Å; Y196-I249 HydrophobicContact CG-CG1 4.2Å; I249-R251 PolarHBondContact O-N 3.33Å; I249-Y252 PolarHBondContact O-N 2.94Å; I249-Y252 VanDerWaalsContact O-N 3.17Å; I249-E253 PolarHBondContact O-N 3.11Å; I249-I280 HydrophobicContact CG2-CG2 4.34Å
250	P	65.4	Low	75.3	Confident	35 Å²	35	32.2 Å²	32.2	23%	0.227	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-29.5	175.8	-21.4	33.9	0	0	0	113	V246 E253 L254 M294	V246-P250 WeakPolarHBondContact O-CD 3.33Å; P250-E253 PolarHBondContact O-N 3.12Å; P250-L254 WeakPolarHBondContact O-CB 3.38Å; P250-L254 WeakPolarHBondContact O-CG 3.18Å; P250-L254 PolarHBondContact O-N 3.19Å; P250-M294 HydrophobicContact CG-CE 3.76Å; P250-M294 HydrophobicContact CG-CG 4.34Å; P250-M294 HydrophobicContact CG-SD 3.38Å; P250-M294 WeakPolarHBondContact CG-SD 3.3Å
251	R	67.2	Low	76.3	Confident	50 Å²	50	35.4 Å²	35.4	19%	0.189	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-38.5	176	-66.8	168.3	-175.1	158.9	-1.3	111.3	E244 Q247 R248 I249 L255	E244-R251 IonicContact OE2-CZ 3.08Å; E244-R251 IonicContact OE2-NH1 2.7Å; E244-R251 PolarHBondContact OE2-NH1 3.26Å; E244-R251 IonicContact OE2-NH2 3.76Å; E244-R251 PolarHBondContact OE2-NH2 3.13Å; Q247-R251 WeakPolarHBondContact O-CD 3.49Å; Q247-R251 VanDerWaalsContact O-CG 3.24Å; Q247-R251 WeakPolarHBondContact O-CG 3.48Å; Q247-R251 PolarHBondContact O-NE 3.27Å; R248-R251 WeakPolarHBondContact O-CB 3.38Å; R248-R251 PolarHBondContact O-N 2.75Å; I249-R251 PolarHBondContact O-N 3.33Å; R251-L255 WeakPolarHBondContact O-CB 3.42Å; R251-L255 WeakPolarHBondContact O-CD1 3.39Å; R251-L255 VanDerWaalsContact O-CG 3.28Å; R251-L255 WeakPolarHBondContact O-CG 3.44Å; R251-L255 PolarHBondContact O-N 3.15Å
252	Y	78.8	Confident	76.7	Confident	5 Å²	5	39.3 Å²	39.3	2%	0.02	19%	0.188	C	C	.	.	H	α-helix	trans	-64.7	-43.2	171.8	-62.5	-46.7	0	0	0	112.1	L110 E114 H161 F165 L189 L193 R248 I249 L256	L110-Y252 HydrophobicContact CD1-CD1 3.79Å; L110-Y252 HydrophobicContact CD1-CE1 3.97Å; E114-Y252 PolarHBondContact OE2-OH 2.87Å; H161-Y252 AromaticContact CE1-CZ 3.89Å; H161-Y252 PolarHBondContact CE1-OH 3.28Å; H161-Y252 PolarHBondContact ND1-OH 2.84Å; F165-Y252 AromaticContact CE1-CE1 3.79Å; F165-Y252 HydrophobicContact CE1-CE1 3.79Å; F165-Y252 HydrophobicContact CZ-CE1 4.31Å; L189-Y252 HydrophobicContact CD2-CD1 4.46Å; L189-Y252 HydrophobicContact CD2-CD2 4.17Å; L189-Y252 HydrophobicContact CD2-CE1 4.46Å; L189-Y252 HydrophobicContact CD2-CE2 4.18Å; L189-Y252 HydrophobicContact CD2-CG 4.33Å; L193-Y252 HydrophobicContact CD1-CD2 4.37Å; L193-Y252 HydrophobicContact CD2-CD2 4.25Å; L193-Y252 HydrophobicContact CD2-CE2 4.02Å; R248-Y252 HydrophobicContact CB-CE2 4.48Å; R248-Y252 HydrophobicContact CG-CD2 4.32Å; R248-Y252 HydrophobicContact CG-CE1 4.09Å; R248-Y252 HydrophobicContact CG-CE2 3.55Å; R248-Y252 VanDerWaalsContact CG-OH 3.26Å; R248-Y252 WeakPolarHBondContact CG-OH 3.46Å; R248-Y252 PolarHBondContact NE-OH 2.98Å; R248-Y252 WeakPolarHBondContact O-CD2 3.2Å; R248-Y252 PolarHBondContact O-N 2.98Å; R248-Y252 VanDerWaalsContact O-N 3.15Å; I249-Y252 PolarHBondContact O-N 2.94Å; I249-Y252 VanDerWaalsContact O-N 3.17Å; Y252-L256 WeakPolarHBondContact O-CB 3.4Å; Y252-L256 PolarHBondContact O-N 3.23Å
253	E	73.2	Confident	77	Confident	33 Å²	33	39.4 Å²	39.4	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-44.9	179.4	-164.1	-168.6	153.1	0	0	111.9	I249 P250 K257 L277 I280	I249-E253 PolarHBondContact O-N 3.11Å; P250-E253 PolarHBondContact O-N 3.12Å; E253-K257 HydrophobicContact CG-CD 4.29Å; E253-K257 VanDerWaalsContact O-CB 3.32Å; E253-K257 WeakPolarHBondContact O-CB 3.24Å; E253-K257 VanDerWaalsContact O-CG 3.27Å; E253-K257 WeakPolarHBondContact O-CG 3.47Å; E253-K257 PolarHBondContact O-N 3.02Å; E253-K257 VanDerWaalsContact OE1-CE 3.27Å; E253-K257 WeakPolarHBondContact OE1-CE 3.44Å; E253-K257 IonicContact OE1-NZ 2.81Å; E253-K257 PolarHBondContact OE1-NZ 3.17Å; E253-L277 HydrophobicContact CB-CD1 4.44Å; E253-L277 HydrophobicContact CG-CD1 3.59Å; E253-I280 HydrophobicContact CB-CG2 4.27Å
254	L	66.8	Low	77.8	Confident	113 Å²	113	42 Å²	42	59%	0.592	21%	0.206	S	C	*	.	H	α-helix	trans	-66.3	-49.1	178	-70.8	172.3	0	0	0	112.6	P250 L256 K257 E258	P250-L254 WeakPolarHBondContact O-CB 3.38Å; P250-L254 WeakPolarHBondContact O-CG 3.18Å; P250-L254 PolarHBondContact O-N 3.19Å; L254-L256 VanDerWaalsContact C-N 3.28Å; L254-L256 PolarHBondContact O-N 3.26Å; L254-K257 PolarHBondContact O-N 3.49Å; L254-E258 PolarHBondContact O-N 3.29Å
255	L	75.5	Confident	78.1	Confident	21 Å²	21	43.3 Å²	43.3	11%	0.11	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-39.9	178.1	-74.1	168.9	0	0	0	111.3	I106 E109 L110 R251 E258 Y259	I106-L255 HydrophobicContact CG2-CB 4.42Å; I106-L255 HydrophobicContact CG2-CD2 4.18Å; I106-L255 WeakPolarHBondContact CG2-O 3.19Å; E109-L255 HydrophobicContact CG-CD2 4.2Å; L110-L255 HydrophobicContact CB-CD1 4.32Å; L110-L255 HydrophobicContact CD1-CD1 3.87Å; R251-L255 WeakPolarHBondContact O-CB 3.42Å; R251-L255 WeakPolarHBondContact O-CD1 3.39Å; R251-L255 VanDerWaalsContact O-CG 3.28Å; R251-L255 WeakPolarHBondContact O-CG 3.44Å; R251-L255 PolarHBondContact O-N 3.15Å; L255-E258 PolarHBondContact O-N 3.02Å; L255-Y259 WeakPolarHBondContact O-CB 3.48Å; L255-Y259 PolarHBondContact O-N 2.91Å
256	L	82.4	Confident	78.1	Confident	4 Å²	4	52 Å²	52	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-74.6	-36.7	179.2	-172.7	58.5	0	0	0	112.9	I186 Y252 L254 E258 Y259 V260 A273 A276 L277 I280	I186-L256 HydrophobicContact CD1-CD1 3.98Å; I186-L256 HydrophobicContact CG2-CD2 4.06Å; Y252-L256 WeakPolarHBondContact O-CB 3.4Å; Y252-L256 PolarHBondContact O-N 3.23Å; L254-L256 VanDerWaalsContact C-N 3.28Å; L254-L256 PolarHBondContact O-N 3.26Å; L256-E258 VanDerWaalsContact C-N 3.34Å; L256-E258 PolarHBondContact O-N 2.94Å; L256-Y259 HydrophobicContact CD1-CD1 4.15Å; L256-Y259 PolarHBondContact O-N 3.2Å; L256-V260 HydrophobicContact CD1-CG2 4.44Å; L256-V260 WeakPolarHBondContact O-CG2 3.41Å; L256-V260 PolarHBondContact O-N 3Å; L256-A273 HydrophobicContact CD1-CB 3.95Å; L256-A276 HydrophobicContact CD2-CB 3.76Å; L256-L277 HydrophobicContact CB-CD1 4.42Å; L256-L277 HydrophobicContact CD2-CB 3.68Å; L256-L277 HydrophobicContact CD2-CD1 4.36Å; L256-L277 VanDerWaalsContact CD2-N 3.32Å; L256-L277 HydrophobicContact CG-CB 4.06Å; L256-L277 HydrophobicContact CG-CD1 4.49Å; L256-I280 HydrophobicContact CD2-CD1 3.77Å
257	K	76.1	Confident	78.6	Confident	84 Å²	84	52.5 Å²	52.5	37%	0.365	27%	0.27	S	S	.	.	H	α-helix	trans	-57.1	-46.2	169.2	-83.3	170.2	172.8	174.5	0	111.2	E253 L254 Q261 L277	E253-K257 HydrophobicContact CG-CD 4.29Å; E253-K257 VanDerWaalsContact O-CB 3.32Å; E253-K257 WeakPolarHBondContact O-CB 3.24Å; E253-K257 VanDerWaalsContact O-CG 3.27Å; E253-K257 WeakPolarHBondContact O-CG 3.47Å; E253-K257 PolarHBondContact O-N 3.02Å; E253-K257 VanDerWaalsContact OE1-CE 3.27Å; E253-K257 WeakPolarHBondContact OE1-CE 3.44Å; E253-K257 IonicContact OE1-NZ 2.81Å; E253-K257 PolarHBondContact OE1-NZ 3.17Å; L254-K257 PolarHBondContact O-N 3.49Å; K257-Q261 VanDerWaalsContact O-CG 3.27Å; K257-Q261 WeakPolarHBondContact O-CG 3.46Å; K257-Q261 PolarHBondContact O-N 3.31Å; K257-L277 HydrophobicContact CG-CD1 3.89Å; K257-L277 HydrophobicContact CG-CD2 3.58Å; K257-L277 HydrophobicContact CG-CG 4.39Å
258	E	76.2	Confident	79.6	Confident	77 Å²	77	54.5 Å²	54.5	36%	0.36	29%	0.289	S	S	.	.	H	α-helix	trans	-67.5	-41.2	176.5	-165.4	176.7	-170.7	0	0	111.6	I106 L254 L255 L256 V260 Q261 K262	I106-E258 HydrophobicContact CD1-CB 4.11Å; I106-E258 HydrophobicContact CD1-CG 3.73Å; L254-E258 PolarHBondContact O-N 3.29Å; L255-E258 PolarHBondContact O-N 3.02Å; L256-E258 VanDerWaalsContact C-N 3.34Å; L256-E258 PolarHBondContact O-N 2.94Å; E258-V260 PolarHBondContact O-N 3.37Å; E258-Q261 CarbonylContact O-C 3.49Å; E258-Q261 WeakPolarHBondContact O-CB 3.42Å; E258-Q261 PolarHBondContact O-N 2.96Å; E258-Q261 VanDerWaalsContact O-N 3.1Å; E258-K262 HydrophobicContact CG-CD 4.36Å; E258-K262 HydrophobicContact CG-CG 4.22Å; E258-K262 WeakPolarHBondContact O-CG 3.24Å; E258-K262 PolarHBondContact O-N 3.37Å; E258-K262 WeakPolarHBondContact OE1-CE 3.33Å; E258-K262 IonicContact OE1-NZ 2.78Å; E258-K262 PolarHBondContact OE1-NZ 3.38Å
259	Y	85.9	Confident	80.1	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-57	-49.1	176.9	-176.3	-101.8	0	0	0	112.2	E103 I106 V107 W176 I182 L255 L256 Q261 K262 L263 D269 A273	E103-Y259 HydrophobicContact CB-CD2 4.08Å; E103-Y259 HydrophobicContact CB-CE2 3.71Å; I106-Y259 HydrophobicContact CB-CD2 4.37Å; I106-Y259 HydrophobicContact CG2-CD2 4.48Å; V107-Y259 HydrophobicContact CG2-CD2 3.99Å; V107-Y259 HydrophobicContact CG2-CE2 3.58Å; W176-Y259 HydrophobicContact CH2-CE2 4.25Å; I182-Y259 HydrophobicContact CG2-CD1 3.95Å; I182-Y259 HydrophobicContact CG2-CD2 4.37Å; I182-Y259 HydrophobicContact CG2-CE1 3.49Å; I182-Y259 VanDerWaalsContact CG2-CE1 3.49Å; I182-Y259 HydrophobicContact CG2-CE2 3.97Å; I182-Y259 HydrophobicContact CG2-CG 4.37Å; L255-Y259 WeakPolarHBondContact O-CB 3.48Å; L255-Y259 PolarHBondContact O-N 2.91Å; L256-Y259 HydrophobicContact CD1-CD1 4.15Å; L256-Y259 PolarHBondContact O-N 3.2Å; Y259-Q261 VanDerWaalsContact C-N 3.26Å; Y259-Q261 PolarHBondContact O-N 2.89Å; Y259-K262 PolarHBondContact O-N 2.95Å; Y259-K262 VanDerWaalsContact O-N 3.15Å; Y259-L263 HydrophobicContact CD1-CD1 3.94Å; Y259-L263 HydrophobicContact CD1-CG 4.11Å; Y259-L263 HydrophobicContact CE1-CD1 3.52Å; Y259-L263 HydrophobicContact CE1-CD2 4.01Å; Y259-L263 HydrophobicContact CE1-CG 3.75Å; Y259-L263 HydrophobicContact CE2-CD2 4.38Å; Y259-L263 WeakPolarHBondContact O-CG 3.2Å; Y259-L263 PolarHBondContact O-N 3.06Å; Y259-D269 VanDerWaalsContact CE1-OD2 3.31Å; Y259-D269 WeakPolarHBondContact CE1-OD2 3.32Å; Y259-D269 PolarHBondContact OH-OD2 3.04Å; Y259-A273 HydrophobicContact CD1-CB 4Å; Y259-A273 HydrophobicContact CE1-CB 4.07Å
260	V	87.7	Confident	80.8	Confident	19 Å²	19	58 Å²	58	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-35.6	175.8	172.2	0	0	0	0	111.8	L256 E258 A273	L256-V260 HydrophobicContact CD1-CG2 4.44Å; L256-V260 WeakPolarHBondContact O-CG2 3.41Å; L256-V260 PolarHBondContact O-N 3Å; E258-V260 PolarHBondContact O-N 3.37Å; V260-A273 HydrophobicContact CG2-CB 3.69Å
261	Q	86.2	Confident	82	Confident	143 Å²	143	59.8 Å²	59.8	67%	0.668	32%	0.319	S	S	*	.	H	α-helix	trans	-72.2	-33.1	175.6	-70.8	172.5	22.5	0	0	113.9	K257 E258 Y259	K257-Q261 VanDerWaalsContact O-CG 3.27Å; K257-Q261 WeakPolarHBondContact O-CG 3.46Å; K257-Q261 PolarHBondContact O-N 3.31Å; E258-Q261 CarbonylContact O-C 3.49Å; E258-Q261 WeakPolarHBondContact O-CB 3.42Å; E258-Q261 PolarHBondContact O-N 2.96Å; E258-Q261 VanDerWaalsContact O-N 3.1Å; Y259-Q261 VanDerWaalsContact C-N 3.26Å; Y259-Q261 PolarHBondContact O-N 2.89Å
262	K	85.4	Confident	83.1	Confident	85 Å²	85	59.6 Å²	59.6	37%	0.37	32%	0.322	S	S	.	.	H	α-helix	trans	-83	-28.9	178.1	-58.8	-40.3	-172	-146.7	0	113.6	P102 I106 E258 Y259	P102-K262 HydrophobicContact CB-CB 4.36Å; P102-K262 HydrophobicContact CB-CG 4.41Å; I106-K262 HydrophobicContact CD1-CB 4.21Å; I106-K262 HydrophobicContact CD1-CG 3.51Å; E258-K262 HydrophobicContact CG-CD 4.36Å; E258-K262 HydrophobicContact CG-CG 4.22Å; E258-K262 WeakPolarHBondContact O-CG 3.24Å; E258-K262 PolarHBondContact O-N 3.37Å; E258-K262 WeakPolarHBondContact OE1-CE 3.33Å; E258-K262 IonicContact OE1-NZ 2.78Å; E258-K262 PolarHBondContact OE1-NZ 3.38Å; Y259-K262 PolarHBondContact O-N 2.95Å; Y259-K262 VanDerWaalsContact O-N 3.15Å
263	L	87.9	Confident	83.8	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	32%	0.321	C	S	.	.	S	Bend	trans	-52.5	137.7	179.7	-88.3	-178.7	0	0	0	111.6	E103 Y259 A267 D269 R270 A273	E103-L263 HydrophobicContact CB-CD2 4.32Å; E103-L263 HydrophobicContact CG-CD2 4.35Å; Y259-L263 HydrophobicContact CD1-CD1 3.94Å; Y259-L263 HydrophobicContact CD1-CG 4.11Å; Y259-L263 HydrophobicContact CE1-CD1 3.52Å; Y259-L263 HydrophobicContact CE1-CD2 4.01Å; Y259-L263 HydrophobicContact CE1-CG 3.75Å; Y259-L263 HydrophobicContact CE2-CD2 4.38Å; Y259-L263 WeakPolarHBondContact O-CG 3.2Å; Y259-L263 PolarHBondContact O-N 3.06Å; L263-A267 HydrophobicContact CB-CB 4.28Å; L263-A267 HydrophobicContact CD2-CB 3.9Å; L263-D269 HydrophobicContact CD1-CB 4.44Å; L263-R270 HydrophobicContact CD1-CB 4.01Å; L263-R270 PolarHBondContact O-NH2 2.93Å; L263-A273 HydrophobicContact CD1-CB 4.32Å
264	P	85.8	Confident	84.6	Confident	67 Å²	67	61.4 Å²	61.4	44%	0.435	33%	0.331	S	S	.	.			trans	-53.1	152.1	171.3	-28.2	33.9	0	0	0	113.3	E103 Q266 A267 R270	E103-P264 WeakPolarHBondContact OE1-CD 3.45Å; P264-Q266 PolarHBondContact O-N 2.97Å; P264-A267 HydrophobicContact CB-CB 4.18Å; P264-A267 HydrophobicContact CG-CB 4.48Å; P264-A267 VanDerWaalsContact O-CB 3.28Å; P264-A267 WeakPolarHBondContact O-CB 3.27Å; P264-A267 PolarHBondContact O-N 3.03Å; P264-R270 PolarHBondContact O-NE 3.41Å
265	A	80.4	Confident	85.8	Confident	73 Å²	73	61.1 Å²	61.1	60%	0.603	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.8	-175.5	0	0	0	0	0	113.7
266	Q	83.8	Confident	86.5	Confident	182 Å²	182	60.1 Å²	60.1	85%	0.85	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	15.8	-179.3	-48.9	-65.5	31.6	0	0	113	P264	P264-Q266 PolarHBondContact O-N 2.97Å
267	A	85.5	Confident	86.7	Confident	18 Å²	18	60.6 Å²	60.6	15%	0.149	32%	0.322	C	S	.	.			trans	-68	128.5	-177.5	0	0	0	0	0	111	L263 P264 D269 R270	L263-A267 HydrophobicContact CB-CB 4.28Å; L263-A267 HydrophobicContact CD2-CB 3.9Å; P264-A267 HydrophobicContact CB-CB 4.18Å; P264-A267 HydrophobicContact CG-CB 4.48Å; P264-A267 VanDerWaalsContact O-CB 3.28Å; P264-A267 WeakPolarHBondContact O-CB 3.27Å; P264-A267 PolarHBondContact O-N 3.03Å; A267-D269 PolarHBondContact O-N 2.99Å; A267-R270 VanDerWaalsContact O-CB 3.28Å; A267-R270 WeakPolarHBondContact O-CB 3.3Å; A267-R270 PolarHBondContact O-N 3.37Å
268	P	83.5	Confident	87.2	Confident	110 Å²	110	60.7 Å²	60.7	71%	0.714	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-29.5	-174.7	25.2	-34.5	0	0	0	112.7	R270	P268-R270 VanDerWaalsContact C-N 3.27Å; P268-R270 PolarHBondContact O-N 2.9Å
269	D	92.2	Very high	87.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-75.1	-10.8	178.6	-160.9	48	0	0	0	113.9	R181 I182 G183 Y259 L263 A267 A271 D272 A273	R181-D269 HydrophobicContact CB-CB 3.56Å; R181-D269 VanDerWaalsContact CB-CG 3.43Å; R181-D269 IonicContact CZ-OD1 2.7Å; R181-D269 IonicContact NE-OD1 2.67Å; R181-D269 PolarHBondContact NE-OD1 2.96Å; R181-D269 IonicContact NH2-OD1 3.78Å; R181-D269 PolarHBondContact NH2-OD1 3.17Å; I182-D269 PolarHBondContact N-OD2 3.23Å; G183-D269 WeakPolarHBondContact CA-OD1 3.32Å; G183-D269 VanDerWaalsContact N-CG 3.28Å; G183-D269 PolarHBondContact N-OD1 2.92Å; G183-D269 PolarHBondContact N-OD2 3.39Å; Y259-D269 VanDerWaalsContact CE1-OD2 3.31Å; Y259-D269 WeakPolarHBondContact CE1-OD2 3.32Å; Y259-D269 PolarHBondContact OH-OD2 3.04Å; L263-D269 HydrophobicContact CD1-CB 4.44Å; A267-D269 PolarHBondContact O-N 2.99Å; D269-A271 VanDerWaalsContact C-N 3.33Å; D269-A271 PolarHBondContact O-N 3.34Å; D269-D272 PolarHBondContact O-N 2.91Å; D269-A273 WeakPolarHBondContact O-CB 3.39Å; D269-A273 PolarHBondContact O-N 3.04Å
270	R	90.3	Very high	87.3	Confident	89 Å²	89	59.7 Å²	59.7	34%	0.336	32%	0.323	S	S	.	.	H	α-helix	trans	-61.4	-40.4	-176.3	-179.7	178.9	-87.1	-146.7	-6.8	112.4	L263 P264 A267 P268 Q274	L263-R270 HydrophobicContact CD1-CB 4.01Å; L263-R270 PolarHBondContact O-NH2 2.93Å; P264-R270 PolarHBondContact O-NE 3.41Å; A267-R270 VanDerWaalsContact O-CB 3.28Å; A267-R270 WeakPolarHBondContact O-CB 3.3Å; A267-R270 PolarHBondContact O-N 3.37Å; P268-R270 VanDerWaalsContact C-N 3.27Å; P268-R270 PolarHBondContact O-N 2.9Å; R270-Q274 WeakPolarHBondContact O-CB 3.32Å; R270-Q274 PolarHBondContact O-N 2.73Å
271	A	90.4	Very high	86.6	Confident	74 Å²	74	63.4 Å²	63.4	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-67.7	-41.5	176.3	0	0	0	0	0	111.7	D269 K275	D269-A271 VanDerWaalsContact C-N 3.33Å; D269-A271 PolarHBondContact O-N 3.34Å; A271-K275 WeakPolarHBondContact O-CB 3.33Å; A271-K275 PolarHBondContact O-N 3.12Å
272	D	92.2	Very high	86	Confident	46 Å²	46	58.8 Å²	58.8	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-70	-36	179.4	-79.1	-44.2	0	0	0	112.5	R181 Q187 D269 A276	R181-D272 IonicContact CZ-OD2 3.66Å; R181-D272 IonicContact NH1-OD2 2.78Å; R181-D272 PolarHBondContact NH1-OD2 3.16Å; R181-D272 VanDerWaalsContact NH2-CG 3.34Å; R181-D272 IonicContact NH2-OD2 3.3Å; R181-D272 PolarHBondContact NH2-OD2 2.88Å; Q187-D272 VanDerWaalsContact NE2-CA 3.29Å; Q187-D272 VanDerWaalsContact NE2-CG 3.3Å; Q187-D272 PolarHBondContact NE2-O 2.96Å; Q187-D272 PolarHBondContact NE2-OD1 2.9Å; D269-D272 PolarHBondContact O-N 2.91Å; D272-A276 WeakPolarHBondContact O-CB 3.27Å; D272-A276 PolarHBondContact O-N 2.97Å
273	A	92.3	Very high	85.2	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-73.2	-40.2	175.9	0	0	0	0	0	112.5	L256 Y259 V260 L263 D269 A276 L277	L256-A273 HydrophobicContact CD1-CB 3.95Å; Y259-A273 HydrophobicContact CD1-CB 4Å; Y259-A273 HydrophobicContact CE1-CB 4.07Å; V260-A273 HydrophobicContact CG2-CB 3.69Å; L263-A273 HydrophobicContact CD1-CB 4.32Å; D269-A273 WeakPolarHBondContact O-CB 3.39Å; D269-A273 PolarHBondContact O-N 3.04Å; A273-A276 PolarHBondContact O-N 2.7Å; A273-L277 PolarHBondContact O-N 3.28Å
274	Q	91	Very high	83.9	Confident	76 Å²	76	56.3 Å²	56.3	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-46.7	172	-177.9	61.6	56	0	0	110.8	R270 A276 L277 D278	R270-Q274 WeakPolarHBondContact O-CB 3.32Å; R270-Q274 PolarHBondContact O-N 2.73Å; Q274-A276 VanDerWaalsContact C-N 3.31Å; Q274-A276 PolarHBondContact O-N 2.97Å; Q274-L277 WeakPolarHBondContact O-CA 3.09Å; Q274-L277 VanDerWaalsContact O-CB 3.3Å; Q274-L277 WeakPolarHBondContact O-CB 3.34Å; Q274-L277 PolarHBondContact O-N 3.25Å; Q274-D278 PolarHBondContact NE2-OD1 3.35Å; Q274-D278 PolarHBondContact O-N 3.16Å
275	K	91.5	Very high	82.6	Confident	107 Å²	107	58 Å²	58	47%	0.465	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-37.3	177.1	-178.2	177.3	165.9	-144	0	112.5	Q187 A271 L277 M279	Q187-K275 HydrophobicContact CG-CG 4.49Å; Q187-K275 VanDerWaalsContact OE1-CD 3.3Å; A271-K275 WeakPolarHBondContact O-CB 3.33Å; A271-K275 PolarHBondContact O-N 3.12Å; K275-L277 VanDerWaalsContact C-N 3.31Å; K275-L277 PolarHBondContact O-N 2.92Å; K275-M279 HydrophobicContact CG-SD 4.13Å; K275-M279 WeakPolarHBondContact O-CB 3.14Å; K275-M279 WeakPolarHBondContact O-CG 3.36Å; K275-M279 PolarHBondContact O-N 3.45Å
276	A	90.9	Very high	81.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-39.8	171.1	0	0	0	0	0	112.2	I186 Q187 L256 D272 A273 Q274 M279 I280	I186-A276 HydrophobicContact CB-CB 3.96Å; I186-A276 HydrophobicContact CG2-CB 3.93Å; Q187-A276 HydrophobicContact CG-CB 3.96Å; L256-A276 HydrophobicContact CD2-CB 3.76Å; D272-A276 WeakPolarHBondContact O-CB 3.27Å; D272-A276 PolarHBondContact O-N 2.97Å; A273-A276 PolarHBondContact O-N 2.7Å; Q274-A276 VanDerWaalsContact C-N 3.31Å; Q274-A276 PolarHBondContact O-N 2.97Å; A276-M279 PolarHBondContact O-N 3.02Å; A276-I280 VanDerWaalsContact O-CG1 3.32Å; A276-I280 WeakPolarHBondContact O-CG1 3.45Å; A276-I280 PolarHBondContact O-N 3.37Å
277	L	86	Confident	80	Confident	14 Å²	14	52.7 Å²	52.7	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-46.8	178.6	179.6	61	0	0	0	111.4	E253 L256 K257 A273 Q274 K275 M279 I280 F281	E253-L277 HydrophobicContact CB-CD1 4.44Å; E253-L277 HydrophobicContact CG-CD1 3.59Å; L256-L277 HydrophobicContact CB-CD1 4.42Å; L256-L277 HydrophobicContact CD2-CB 3.68Å; L256-L277 HydrophobicContact CD2-CD1 4.36Å; L256-L277 VanDerWaalsContact CD2-N 3.32Å; L256-L277 HydrophobicContact CG-CB 4.06Å; L256-L277 HydrophobicContact CG-CD1 4.49Å; K257-L277 HydrophobicContact CG-CD1 3.89Å; K257-L277 HydrophobicContact CG-CD2 3.58Å; K257-L277 HydrophobicContact CG-CG 4.39Å; A273-L277 PolarHBondContact O-N 3.28Å; Q274-L277 WeakPolarHBondContact O-CA 3.09Å; Q274-L277 VanDerWaalsContact O-CB 3.3Å; Q274-L277 WeakPolarHBondContact O-CB 3.34Å; Q274-L277 PolarHBondContact O-N 3.25Å; K275-L277 VanDerWaalsContact C-N 3.31Å; K275-L277 PolarHBondContact O-N 2.92Å; L277-M279 PolarHBondContact O-N 3.05Å; L277-I280 PolarHBondContact O-N 3.13Å; L277-F281 WeakPolarHBondContact O-CB 3.48Å; L277-F281 PolarHBondContact O-N 3.18Å
278	D	85.6	Confident	78.1	Confident	86 Å²	86	57.6 Å²	57.6	46%	0.46	31%	0.308	S	S	.	.	H	α-helix	trans	-59.6	-38.3	176.5	-53.7	-26.3	0	0	0	111	Q274 S282	Q274-D278 PolarHBondContact NE2-OD1 3.35Å; Q274-D278 PolarHBondContact O-N 3.16Å; D278-S282 VanDerWaalsContact O-CB 3.23Å; D278-S282 WeakPolarHBondContact O-CB 3.43Å; D278-S282 PolarHBondContact O-N 3.1Å
279	M	84.8	Confident	76.5	Confident	58 Å²	58	56.1 Å²	56.1	29%	0.286	30%	0.304	S	S	.	.	H	α-helix	trans	-71.1	-37.4	176.3	-70.5	171.6	66.4	0	0	113.4	Q187 A190 P191 K275 A276 L277 A283	Q187-M279 HydrophobicContact CG-SD 4.16Å; A190-M279 HydrophobicContact CB-CB 3.55Å; A190-M279 HydrophobicContact CB-CE 4.24Å; P191-M279 HydrophobicContact CG-CE 3.69Å; K275-M279 HydrophobicContact CG-SD 4.13Å; K275-M279 WeakPolarHBondContact O-CB 3.14Å; K275-M279 WeakPolarHBondContact O-CG 3.36Å; K275-M279 PolarHBondContact O-N 3.45Å; A276-M279 PolarHBondContact O-N 3.02Å; L277-M279 PolarHBondContact O-N 3.05Å; M279-A283 WeakPolarHBondContact O-CB 3.26Å; M279-A283 PolarHBondContact O-N 3.25Å
280	I	80.3	Confident	74.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.4	-48.6	173.7	-72.1	164.7	0	0	0	110.1	I186 A190 L193 I249 E253 L256 A276 L277 S282 A283 A284	I186-I280 HydrophobicContact CG2-CD1 3.6Å; A190-I280 HydrophobicContact CB-CG1 3.95Å; L193-I280 HydrophobicContact CD1-CB 4.34Å; L193-I280 HydrophobicContact CD1-CG1 3.75Å; L193-I280 HydrophobicContact CD1-CG2 4.17Å; I249-I280 HydrophobicContact CG2-CG2 4.34Å; E253-I280 HydrophobicContact CB-CG2 4.27Å; L256-I280 HydrophobicContact CD2-CD1 3.77Å; A276-I280 VanDerWaalsContact O-CG1 3.32Å; A276-I280 WeakPolarHBondContact O-CG1 3.45Å; A276-I280 PolarHBondContact O-N 3.37Å; L277-I280 PolarHBondContact O-N 3.13Å; I280-S282 PolarHBondContact O-N 3.21Å; I280-A283 PolarHBondContact O-N 3.15Å; I280-A283 VanDerWaalsContact O-N 3.16Å; I280-A284 PolarHBondContact O-N 3.19Å; I280-A284 VanDerWaalsContact O-N 3.1Å
281	F	73.3	Confident	72.6	Confident	97 Å²	97	54.7 Å²	54.7	43%	0.425	31%	0.306	S	S	.	.	H	α-helix	trans	-60.3	-45.6	178.6	-175.3	-105.4	0	0	0	111.3	L277 A283 A284 Q285	L277-F281 WeakPolarHBondContact O-CB 3.48Å; L277-F281 PolarHBondContact O-N 3.18Å; F281-A283 PolarHBondContact O-N 2.93Å; F281-A284 PolarHBondContact O-N 3.19Å; F281-Q285 HydrophobicContact CD1-CG 4.38Å; F281-Q285 HydrophobicContact CE1-CG 4.16Å; F281-Q285 VanDerWaalsContact CE1-NE2 3.25Å; F281-Q285 HydrophobicContact CZ-CG 4.38Å; F281-Q285 WeakPolarHBondContact O-CG 3.31Å; F281-Q285 PolarHBondContact O-N 2.85Å
282	S	73.8	Confident	71.1	Confident	45 Å²	45	55.7 Å²	55.7	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-39.4	173.2	175.7	0	0	0	0	113.2	D278 I280 A284 Q285 H286	D278-S282 VanDerWaalsContact O-CB 3.23Å; D278-S282 WeakPolarHBondContact O-CB 3.43Å; D278-S282 PolarHBondContact O-N 3.1Å; I280-S282 PolarHBondContact O-N 3.21Å; S282-A284 VanDerWaalsContact C-N 3.33Å; S282-A284 PolarHBondContact O-N 3.39Å; S282-Q285 PolarHBondContact O-N 2.94Å; S282-H286 PolarHBondContact O-CD2 3.06Å; S282-H286 PolarHBondContact O-N 2.65Å; S282-H286 VanDerWaalsContact O-N 3.1Å
283	A	68.3	Low	69.3	Low	5 Å²	5	55.9 Å²	55.9	4%	0.041	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-36.9	177.7	0	0	0	0	0	112.4	L193 K194 M279 I280 F281	L193-A283 HydrophobicContact CB-CB 4.02Å; K194-A283 HydrophobicContact CG-CB 4.14Å; M279-A283 WeakPolarHBondContact O-CB 3.26Å; M279-A283 PolarHBondContact O-N 3.25Å; I280-A283 PolarHBondContact O-N 3.15Å; I280-A283 VanDerWaalsContact O-N 3.16Å; F281-A283 PolarHBondContact O-N 2.93Å
284	A	61.2	Low	67.4	Low	35 Å²	35	57.9 Å²	57.9	29%	0.289	31%	0.313	S	S	.	.	H	α-helix	trans	-67.3	-46.1	170.3	0	0	0	0	0	111.8	I280 F281 S282 H286 S287	I280-A284 PolarHBondContact O-N 3.19Å; I280-A284 VanDerWaalsContact O-N 3.1Å; F281-A284 PolarHBondContact O-N 3.19Å; S282-A284 VanDerWaalsContact C-N 3.33Å; S282-A284 PolarHBondContact O-N 3.39Å; A284-H286 PolarHBondContact O-N 2.79Å; A284-S287 PolarHBondContact O-N 2.92Å
285	Q	58.3	Low	65.9	Low	102 Å²	102	59.1 Å²	59.1	48%	0.477	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-18	-179	-77	-167.8	-36.3	0	0	115.5	F281 S282 S287	F281-Q285 HydrophobicContact CD1-CG 4.38Å; F281-Q285 HydrophobicContact CE1-CG 4.16Å; F281-Q285 VanDerWaalsContact CE1-NE2 3.25Å; F281-Q285 HydrophobicContact CZ-CG 4.38Å; F281-Q285 WeakPolarHBondContact O-CG 3.31Å; F281-Q285 PolarHBondContact O-N 2.85Å; S282-Q285 PolarHBondContact O-N 2.94Å; Q285-S287 PolarHBondContact O-N 3.25Å
286	H	56.6	Low	64.8	Low	122 Å²	122	56.9 Å²	56.9	57%	0.565	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	5.9	177.4	-87.5	-65.2	0	0	0	114.6	K194 S282 A284	K194-H286 PolarHBondContact NZ-CD2 2.91Å; K194-H286 PolarHBondContact NZ-NE2 3.34Å; S282-H286 PolarHBondContact O-CD2 3.06Å; S282-H286 PolarHBondContact O-N 2.65Å; S282-H286 VanDerWaalsContact O-N 3.1Å; A284-H286 PolarHBondContact O-N 2.79Å
287	S	51.9	Low	63.2	Low	21 Å²	21	58.5 Å²	58.5	15%	0.147	32%	0.316	C	S	.	.			trans	-135.9	56	-162.5	-49.4	0	0	0	0	113	S197 A284 Q285 A289 A290 I291	S197-S287 WeakPolarHBondContact CB-OG 3.38Å; A284-S287 PolarHBondContact O-N 2.92Å; Q285-S287 PolarHBondContact O-N 3.25Å; S287-A289 VanDerWaalsContact C-N 3.3Å; S287-A289 PolarHBondContact O-N 3.38Å; S287-A290 CarbonylContact O-C 3.22Å; S287-A290 VanDerWaalsContact O-CA 3.31Å; S287-A290 WeakPolarHBondContact O-CA 3.43Å; S287-A290 VanDerWaalsContact O-CB 3.3Å; S287-A290 WeakPolarHBondContact O-CB 3.45Å; S287-A290 PolarHBondContact O-N 3.19Å; S287-I291 PolarHBondContact O-N 3.38Å
288	N	45.6	Very low	61.7	Low	122 Å²	122	62.9 Å²	62.9	65%	0.652	34%	0.336	S	S	*	.	H	α-helix	trans	-40.1	-43.5	-167.4	-66.2	15.6	0	0	0	117.3	I291 T292	N288-I291 WeakPolarHBondContact O-CB 3.43Å; N288-I291 PolarHBondContact O-N 3.02Å; N288-I291 VanDerWaalsContact O-N 3.15Å; N288-T292 PolarHBondContact O-N 2.97Å; N288-T292 VanDerWaalsContact O-N 3.15Å; N288-T292 PolarHBondContact O-OG1 3.28Å
289	A	50.6	Low	60.8	Low	78 Å²	78	63.9 Å²	63.9	65%	0.645	34%	0.342	S	S	*	.	H	α-helix	trans	-65.9	-37.4	176.2	0	0	0	0	0	113.2	S287 I291 E293	S287-A289 VanDerWaalsContact C-N 3.3Å; S287-A289 PolarHBondContact O-N 3.38Å; A289-I291 VanDerWaalsContact C-N 3.31Å; A289-E293 WeakPolarHBondContact O-CB 3.19Å; A289-E293 PolarHBondContact O-N 2.98Å
290	A	49.9	Very low	60.1	Low	16 Å²	16	61.5 Å²	61.5	13%	0.132	33%	0.33	C	S	.	.	H	α-helix	trans	-72.1	-21.9	171.4	0	0	0	0	0	112.9	V200 S287 M294	V200-A290 HydrophobicContact CB-CB 3.84Å; V200-A290 HydrophobicContact CG1-CB 3.43Å; V200-A290 VanDerWaalsContact CG1-CB 3.43Å; S287-A290 CarbonylContact O-C 3.22Å; S287-A290 VanDerWaalsContact O-CA 3.31Å; S287-A290 WeakPolarHBondContact O-CA 3.43Å; S287-A290 VanDerWaalsContact O-CB 3.3Å; S287-A290 WeakPolarHBondContact O-CB 3.45Å; S287-A290 PolarHBondContact O-N 3.19Å; A290-M294 WeakPolarHBondContact O-CB 3.4Å; A290-M294 PolarHBondContact O-N 2.64Å
291	I	50.8	Low	59.4	Low	45 Å²	45	65.1 Å²	65.1	23%	0.231	34%	0.344	C	S	.	.	H	α-helix	trans	-67	-55.4	170	-54.2	176.2	0	0	0	108.8	S287 N288 A289 E293 M294 E295	S287-I291 PolarHBondContact O-N 3.38Å; N288-I291 WeakPolarHBondContact O-CB 3.43Å; N288-I291 PolarHBondContact O-N 3.02Å; N288-I291 VanDerWaalsContact O-N 3.15Å; A289-I291 VanDerWaalsContact C-N 3.31Å; I291-E293 VanDerWaalsContact C-N 3.28Å; I291-E293 PolarHBondContact O-N 2.82Å; I291-M294 CarbonylContact O-C 3.6Å; I291-M294 WeakPolarHBondContact O-CA 3.39Å; I291-M294 WeakPolarHBondContact O-CB 3.31Å; I291-M294 PolarHBondContact O-N 3.48Å; I291-E295 HydrophobicContact CG2-CG 4.23Å; I291-E295 WeakPolarHBondContact O-CG 3.32Å; I291-E295 PolarHBondContact O-N 2.88Å
292	T	57.3	Low	59.2	Low	94 Å²	94	65.5 Å²	65.5	58%	0.577	35%	0.347	S	S	*	.	H	α-helix	trans	-59.8	-38.1	179.6	-55.1	0	0	0	0	112.4	N288 R296	N288-T292 PolarHBondContact O-N 2.97Å; N288-T292 VanDerWaalsContact O-N 3.15Å; N288-T292 PolarHBondContact O-OG1 3.28Å; T292-R296 VanDerWaalsContact O-CB 3.27Å; T292-R296 WeakPolarHBondContact O-CB 3.38Å; T292-R296 PolarHBondContact O-N 3.45Å
293	E	56.3	Low	59.4	Low	51 Å²	51	63.6 Å²	63.6	24%	0.238	33%	0.333	C	S	.	.	H	α-helix	trans	-69.5	-36.3	174	-179.7	60	-174.5	0	0	112.4	A289 I291 R296 L297	A289-E293 WeakPolarHBondContact O-CB 3.19Å; A289-E293 PolarHBondContact O-N 2.98Å; I291-E293 VanDerWaalsContact C-N 3.28Å; I291-E293 PolarHBondContact O-N 2.82Å; E293-R296 VanDerWaalsContact CD-NH2 3.33Å; E293-R296 IonicContact OE1-CZ 3.45Å; E293-R296 IonicContact OE1-NE 3.46Å; E293-R296 IonicContact OE1-NH2 2.68Å; E293-R296 PolarHBondContact OE1-NH2 2.77Å; E293-R296 IonicContact OE2-CZ 3.36Å; E293-R296 IonicContact OE2-NE 2.82Å; E293-R296 PolarHBondContact OE2-NE 3.28Å; E293-R296 IonicContact OE2-NH2 3.36Å; E293-R296 PolarHBondContact OE2-NH2 3.44Å; E293-L297 HydrophobicContact CG-CD1 4.07Å; E293-L297 VanDerWaalsContact O-CB 3.31Å; E293-L297 WeakPolarHBondContact O-CB 3.31Å; E293-L297 WeakPolarHBondContact O-CG 3.1Å; E293-L297 PolarHBondContact O-N 3.35Å
294	M	51.9	Low	59.3	Low	41 Å²	41	63.6 Å²	63.6	20%	0.202	33%	0.332	C	S	.	.	H	α-helix	trans	-66.6	-44.6	174.1	-171	71	75.3	0	0	111.9	V246 P250 A290 I291 L297 Q298	V246-M294 HydrophobicContact CG1-CE 4.12Å; P250-M294 HydrophobicContact CG-CE 3.76Å; P250-M294 HydrophobicContact CG-CG 4.34Å; P250-M294 HydrophobicContact CG-SD 3.38Å; P250-M294 WeakPolarHBondContact CG-SD 3.3Å; A290-M294 WeakPolarHBondContact O-CB 3.4Å; A290-M294 PolarHBondContact O-N 2.64Å; I291-M294 CarbonylContact O-C 3.6Å; I291-M294 WeakPolarHBondContact O-CA 3.39Å; I291-M294 WeakPolarHBondContact O-CB 3.31Å; I291-M294 PolarHBondContact O-N 3.48Å; M294-L297 PolarHBondContact O-N 3.17Å; M294-Q298 VanDerWaalsContact O-CB 3.3Å; M294-Q298 WeakPolarHBondContact O-CB 3.5Å; M294-Q298 PolarHBondContact O-N 3.39Å
295	E	59.7	Low	59.4	Low	102 Å²	102	66.3 Å²	66.3	48%	0.477	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-48.1	175.9	-70.6	169.2	153.1	0	0	110.2	I291 L297 Q298 D299	I291-E295 HydrophobicContact CG2-CG 4.23Å; I291-E295 WeakPolarHBondContact O-CG 3.32Å; I291-E295 PolarHBondContact O-N 2.88Å; E295-L297 VanDerWaalsContact C-N 3.35Å; E295-L297 PolarHBondContact O-N 3.21Å; E295-Q298 WeakPolarHBondContact O-CB 3.09Å; E295-Q298 PolarHBondContact O-N 2.77Å; E295-Q298 VanDerWaalsContact O-N 3.09Å; E295-D299 PolarHBondContact O-N 3.47Å
296	R	68.1	Low	60.4	Low	61 Å²	61	63.7 Å²	63.7	23%	0.23	32%	0.324	C	S	.	.	H	α-helix	trans	-58	-44	174.6	-170.1	-168.9	72	78.3	4.4	112.4	T292 E293 Q298 L300 P316 N318	T292-R296 VanDerWaalsContact O-CB 3.27Å; T292-R296 WeakPolarHBondContact O-CB 3.38Å; T292-R296 PolarHBondContact O-N 3.45Å; E293-R296 VanDerWaalsContact CD-NH2 3.33Å; E293-R296 IonicContact OE1-CZ 3.45Å; E293-R296 IonicContact OE1-NE 3.46Å; E293-R296 IonicContact OE1-NH2 2.68Å; E293-R296 PolarHBondContact OE1-NH2 2.77Å; E293-R296 IonicContact OE2-CZ 3.36Å; E293-R296 IonicContact OE2-NE 2.82Å; E293-R296 PolarHBondContact OE2-NE 3.28Å; E293-R296 IonicContact OE2-NH2 3.36Å; E293-R296 PolarHBondContact OE2-NH2 3.44Å; R296-Q298 VanDerWaalsContact C-N 3.33Å; R296-L300 WeakPolarHBondContact O-CB 3.25Å; R296-L300 PolarHBondContact O-N 2.75Å; R296-P316 PolarHBondContact NH1-O 3.15Å; R296-P316 PolarHBondContact NH2-O 2.71Å; R296-N318 PolarHBondContact NH1-O 2.91Å
297	L	56.8	Low	61.2	Low	34 Å²	34	58.1 Å²	58.1	18%	0.178	30%	0.299	C	S	.	.	H	α-helix	trans	-69.5	-29.5	176.9	-72.8	170.9	0	0	0	112.5	V246 E293 M294 E295 L300 W301 P316	V246-L297 HydrophobicContact CG1-CD1 4.23Å; E293-L297 HydrophobicContact CG-CD1 4.07Å; E293-L297 VanDerWaalsContact O-CB 3.31Å; E293-L297 WeakPolarHBondContact O-CB 3.31Å; E293-L297 WeakPolarHBondContact O-CG 3.1Å; E293-L297 PolarHBondContact O-N 3.35Å; M294-L297 PolarHBondContact O-N 3.17Å; E295-L297 VanDerWaalsContact C-N 3.35Å; E295-L297 PolarHBondContact O-N 3.21Å; L297-L300 HydrophobicContact CD2-CD2 4.37Å; L297-W301 VanDerWaalsContact O-CB 3.25Å; L297-W301 WeakPolarHBondContact O-CB 3.32Å; L297-W301 PolarHBondContact O-N 3.29Å; L297-P316 HydrophobicContact CD2-CB 4.07Å
298	Q	54.6	Low	61.7	Low	105 Å²	105	58.3 Å²	58.3	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-72.9	-47.9	176.1	-178.6	170.8	-16.1	0	0	111.5	M294 E295 R296 L300 W301 E302	M294-Q298 VanDerWaalsContact O-CB 3.3Å; M294-Q298 WeakPolarHBondContact O-CB 3.5Å; M294-Q298 PolarHBondContact O-N 3.39Å; E295-Q298 WeakPolarHBondContact O-CB 3.09Å; E295-Q298 PolarHBondContact O-N 2.77Å; E295-Q298 VanDerWaalsContact O-N 3.09Å; R296-Q298 VanDerWaalsContact C-N 3.33Å; Q298-L300 VanDerWaalsContact C-N 3.3Å; Q298-L300 PolarHBondContact O-N 2.94Å; Q298-W301 WeakPolarHBondContact O-CA 3.28Å; Q298-W301 WeakPolarHBondContact O-CB 3.27Å; Q298-W301 PolarHBondContact O-N 3.23Å; Q298-W301 VanDerWaalsContact O-N 3.07Å; Q298-E302 PolarHBondContact O-N 3.46Å
299	D	67.8	Low	62	Low	108 Å²	108	53.6 Å²	53.6	58%	0.578	28%	0.279	S	S	*	.	H	α-helix	trans	-56.9	-46.1	173.3	-73	-13.9	0	0	0	110.9	E295 W301 E302 V303	E295-D299 PolarHBondContact O-N 3.47Å; D299-W301 VanDerWaalsContact C-N 3.29Å; D299-W301 PolarHBondContact O-N 3.33Å; D299-E302 PolarHBondContact O-N 3.28Å; D299-V303 WeakPolarHBondContact O-CG2 3.27Å; D299-V303 PolarHBondContact O-N 3.1Å
300	L	69.8	Low	61.8	Low	7 Å²	7	53.1 Å²	53.1	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-36.6	175.9	-174.9	66.9	0	0	0	112.2	R296 L297 Q298 V303 Y304 N318 F344	R296-L300 WeakPolarHBondContact O-CB 3.25Å; R296-L300 PolarHBondContact O-N 2.75Å; L297-L300 HydrophobicContact CD2-CD2 4.37Å; Q298-L300 VanDerWaalsContact C-N 3.3Å; Q298-L300 PolarHBondContact O-N 2.94Å; L300-V303 WeakPolarHBondContact O-CB 3.42Å; L300-V303 PolarHBondContact O-N 3.44Å; L300-Y304 HydrophobicContact CD1-CE1 4.25Å; L300-Y304 HydrophobicContact CD1-CE2 3.92Å; L300-Y304 HydrophobicContact CD2-CE2 3.86Å; L300-Y304 HydrophobicContact CG-CD2 4.13Å; L300-Y304 HydrophobicContact CG-CE2 3.48Å; L300-Y304 VanDerWaalsContact CG-CE2 3.48Å; L300-Y304 VanDerWaalsContact O-CD2 3.27Å; L300-Y304 WeakPolarHBondContact O-CD2 3.25Å; L300-Y304 PolarHBondContact O-N 3.24Å; L300-N318 HydrophobicContact CD1-CB 4.07Å; L300-N318 HydrophobicContact CD2-CB 4.49Å; L300-N318 WeakPolarHBondContact CD2-O 3.45Å; L300-F344 HydrophobicContact CD1-CD1 4.23Å; L300-F344 HydrophobicContact CD1-CE1 3.71Å
301	W	65.3	Low	61.2	Low	77 Å²	77	54 Å²	54	29%	0.292	27%	0.266	S	S	.	.	H	α-helix	trans	-68.4	-41	175.8	-176.6	-113.8	0	0	0	112.3	L80 L297 Q298 D299 V303 Y304 Q305 L309	L80-W301 HydrophobicContact CD1-CH2 4.5Å; L80-W301 HydrophobicContact CD1-CZ2 3.87Å; L297-W301 VanDerWaalsContact O-CB 3.25Å; L297-W301 WeakPolarHBondContact O-CB 3.32Å; L297-W301 PolarHBondContact O-N 3.29Å; Q298-W301 WeakPolarHBondContact O-CA 3.28Å; Q298-W301 WeakPolarHBondContact O-CB 3.27Å; Q298-W301 PolarHBondContact O-N 3.23Å; Q298-W301 VanDerWaalsContact O-N 3.07Å; D299-W301 VanDerWaalsContact C-N 3.29Å; D299-W301 PolarHBondContact O-N 3.33Å; W301-V303 VanDerWaalsContact C-N 3.31Å; W301-V303 PolarHBondContact O-N 2.95Å; W301-Y304 PolarHBondContact O-N 2.94Å; W301-Q305 WeakPolarHBondContact O-CG 2.94Å; W301-Q305 PolarHBondContact O-N 3.29Å; W301-L309 HydrophobicContact CE3-CD2 4.2Å; W301-L309 HydrophobicContact CH2-CD1 4.2Å; W301-L309 HydrophobicContact CH2-CD2 3.76Å; W301-L309 HydrophobicContact CZ3-CD2 3.55Å
302	E	68.9	Low	60.9	Low	105 Å²	105	55.4 Å²	55.4	49%	0.491	27%	0.274	S	S	.	.	H	α-helix	trans	-63	-36.9	173.6	-68.4	-165	-174	0	0	112.2	Q298 D299 Q305 R306	Q298-E302 PolarHBondContact O-N 3.46Å; D299-E302 PolarHBondContact O-N 3.28Å; E302-Q305 PolarHBondContact O-N 2.87Å; E302-R306 WeakPolarHBondContact O-CG 3.38Å; E302-R306 PolarHBondContact O-N 3.5Å; E302-R306 VanDerWaalsContact O-N 3.16Å; E302-R306 PolarHBondContact O-NE 3.39Å
303	V	76.8	Confident	60.8	Low	4 Å²	4	51.2 Å²	51.2	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-49.8	170.4	173	0	0	0	0	111	D299 L300 W301 Q305 R306 L307 L320 F342 F344	D299-V303 WeakPolarHBondContact O-CG2 3.27Å; D299-V303 PolarHBondContact O-N 3.1Å; L300-V303 WeakPolarHBondContact O-CB 3.42Å; L300-V303 PolarHBondContact O-N 3.44Å; W301-V303 VanDerWaalsContact C-N 3.31Å; W301-V303 PolarHBondContact O-N 2.95Å; V303-Q305 PolarHBondContact O-N 3.43Å; V303-R306 VanDerWaalsContact CG2-NH2 3.3Å; V303-R306 PolarHBondContact O-N 3.16Å; V303-L307 HydrophobicContact CG1-CD1 3.76Å; V303-L307 WeakPolarHBondContact O-CG 3.36Å; V303-L307 PolarHBondContact O-N 2.96Å; V303-L320 HydrophobicContact CG1-CD1 4.43Å; V303-L320 HydrophobicContact CG2-CD2 3.83Å; V303-F342 HydrophobicContact CG1-CD1 3.67Å; V303-F342 HydrophobicContact CG1-CE1 3.94Å; V303-F344 HydrophobicContact CG1-CE1 4.05Å; V303-F344 HydrophobicContact CG1-CZ 3.61Å
304	Y	67.6	Low	60.4	Low	6 Å²	6	51 Å²	51	2%	0.024	25%	0.25	C	C	.	.	H	α-helix	trans	-66.4	-32.5	179.7	-64.7	-38.8	0	0	0	113.7	L300 W301 L307 G308 L309 I313 V314 D315 N318 F344	L300-Y304 HydrophobicContact CD1-CE1 4.25Å; L300-Y304 HydrophobicContact CD1-CE2 3.92Å; L300-Y304 HydrophobicContact CD2-CE2 3.86Å; L300-Y304 HydrophobicContact CG-CD2 4.13Å; L300-Y304 HydrophobicContact CG-CE2 3.48Å; L300-Y304 VanDerWaalsContact CG-CE2 3.48Å; L300-Y304 VanDerWaalsContact O-CD2 3.27Å; L300-Y304 WeakPolarHBondContact O-CD2 3.25Å; L300-Y304 PolarHBondContact O-N 3.24Å; W301-Y304 PolarHBondContact O-N 2.94Å; Y304-L307 HydrophobicContact CD1-CD1 4.15Å; Y304-L307 PolarHBondContact O-N 3.48Å; Y304-G308 PolarHBondContact O-N 3.45Å; Y304-L309 PolarHBondContact O-N 3.07Å; Y304-I313 HydrophobicContact CD1-CG2 4.41Å; Y304-I313 HydrophobicContact CE1-CG2 4.11Å; Y304-I313 WeakPolarHBondContact CE1-O 3.42Å; Y304-I313 PolarHBondContact OH-O 3.34Å; Y304-V314 HydrophobicContact CD1-CG2 4.22Å; Y304-V314 HydrophobicContact CD2-CB 4.4Å; Y304-V314 HydrophobicContact CD2-CG1 3.94Å; Y304-V314 HydrophobicContact CD2-CG2 4.07Å; Y304-V314 HydrophobicContact CE2-CB 4.23Å; Y304-V314 HydrophobicContact CE2-CG1 3.79Å; Y304-V314 HydrophobicContact CE2-CG2 4.35Å; Y304-V314 HydrophobicContact CG-CG2 4.01Å; Y304-D315 PolarHBondContact OH-N 3.07Å; Y304-D315 VanDerWaalsContact OH-N 3.17Å; Y304-D315 PolarHBondContact OH-O 2.83Å; Y304-N318 WeakPolarHBondContact OH-CB 3.23Å; Y304-N318 PolarHBondContact OH-ND2 3.24Å; Y304-F344 HydrophobicContact CE1-CE1 4.44Å; Y304-F344 HydrophobicContact CE1-CZ 4.3Å
305	Q	63.7	Low	60.5	Low	92 Å²	92	52 Å²	52	43%	0.43	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-43.2	171.6	-74.1	-169.7	14.5	0	0	112	W301 E302 V303 G308	W301-Q305 WeakPolarHBondContact O-CG 2.94Å; W301-Q305 PolarHBondContact O-N 3.29Å; E302-Q305 PolarHBondContact O-N 2.87Å; V303-Q305 PolarHBondContact O-N 3.43Å; Q305-G308 PolarHBondContact O-N 3.39Å
306	R	79.3	Confident	60	Low	46 Å²	46	48.6 Å²	48.6	17%	0.174	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-36.5	176.6	-70.2	-177.7	-72	139	-4.6	112.2	E302 V303 E323 A360 Q361 F362	E302-R306 WeakPolarHBondContact O-CG 3.38Å; E302-R306 PolarHBondContact O-N 3.5Å; E302-R306 VanDerWaalsContact O-N 3.16Å; E302-R306 PolarHBondContact O-NE 3.39Å; V303-R306 VanDerWaalsContact CG2-NH2 3.3Å; V303-R306 PolarHBondContact O-N 3.16Å; R306-E323 IonicContact CZ-OE1 2.7Å; R306-E323 IonicContact CZ-OE2 3.52Å; R306-E323 IonicContact NH1-OE1 3.67Å; R306-E323 PolarHBondContact NH1-OE1 3Å; R306-E323 IonicContact NH1-OE2 2.83Å; R306-E323 PolarHBondContact NH1-OE2 3.2Å; R306-E323 IonicContact NH2-OE1 3.68Å; R306-E323 PolarHBondContact NH2-OE1 3.27Å; R306-E323 IonicContact NH2-OE2 3.4Å; R306-E323 PolarHBondContact NH2-OE2 2.96Å; R306-A360 CarbonylContact O-C 3.59Å; R306-Q361 HydrophobicContact CB-CB 4.48Å; R306-Q361 HydrophobicContact CG-CG 4.41Å; R306-Q361 PolarHBondContact O-N 2.88Å; R306-F362 HydrophobicContact CB-CD2 4.12Å; R306-F362 HydrophobicContact CB-CE2 4.36Å; R306-F362 PolarHBondContact O-N 2.82Å
307	L	72.7	Confident	59.3	Low	5 Å²	5	49.1 Å²	49.1	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-71.7	-27.1	173.7	-75	164.4	0	0	0	113.9	V303 Y304 F342 F344 L349 V364	V303-L307 HydrophobicContact CG1-CD1 3.76Å; V303-L307 WeakPolarHBondContact O-CG 3.36Å; V303-L307 PolarHBondContact O-N 2.96Å; Y304-L307 HydrophobicContact CD1-CD1 4.15Å; Y304-L307 PolarHBondContact O-N 3.48Å; L307-F342 HydrophobicContact CD1-CD2 4.5Å; L307-F342 HydrophobicContact CD1-CG 4.38Å; L307-F342 HydrophobicContact CD2-CD2 3.51Å; L307-F342 HydrophobicContact CD2-CE2 3.46Å; L307-F342 VanDerWaalsContact CD2-CE2 3.46Å; L307-F342 HydrophobicContact CD2-CG 4.19Å; L307-F342 HydrophobicContact CD2-CZ 4.1Å; L307-F342 HydrophobicContact CG-CD2 4.17Å; L307-F342 HydrophobicContact CG-CE1 4.42Å; L307-F342 HydrophobicContact CG-CE2 3.98Å; L307-F342 HydrophobicContact CG-CG 4.47Å; L307-F342 HydrophobicContact CG-CZ 4.11Å; L307-F344 HydrophobicContact CD1-CZ 4.23Å; L307-L349 HydrophobicContact CD1-CD1 3.54Å; L307-L349 HydrophobicContact CD2-CD1 3.79Å; L307-L349 HydrophobicContact CG-CD1 4.33Å; L307-V364 HydrophobicContact CD2-CG2 3.74Å
308	G	62.3	Low	59.8	Low	26 Å²	26	47.5 Å²	47.5	27%	0.268	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	13.9	175.2	0	0	0	0	0	116.6	Y304 Q305 A360	Y304-G308 PolarHBondContact O-N 3.45Å; Q305-G308 PolarHBondContact O-N 3.39Å; G308-A360 VanDerWaalsContact CA-CB 3.44Å
309	L	52.7	Low	61	Low	23 Å²	23	44.9 Å²	44.9	12%	0.12	24%	0.239	C	C	.	.			trans	56	62.9	177	-61	161.4	0	0	0	112.7	L73 W301 Y304 V314	L73-L309 HydrophobicContact CD1-CB 4.31Å; L73-L309 VanDerWaalsContact CD1-O 3.24Å; L73-L309 WeakPolarHBondContact CD1-O 3.45Å; W301-L309 HydrophobicContact CE3-CD2 4.2Å; W301-L309 HydrophobicContact CH2-CD1 4.2Å; W301-L309 HydrophobicContact CH2-CD2 3.76Å; W301-L309 HydrophobicContact CZ3-CD2 3.55Å; Y304-L309 PolarHBondContact O-N 3.07Å; L309-V314 HydrophobicContact CD2-CG2 4.31Å
310	E	45.4	Very low	61.9	Low	67 Å²	67	42.4 Å²	42.4	31%	0.313	23%	0.225	S	C	.	.			trans	-86.6	129	171.3	-64	-177.5	158.8	0	0	109.4	D312 I313 V364	E310-D312 PolarHBondContact O-N 2.93Å; E310-D312 VanDerWaalsContact O-N 3.11Å; E310-I313 HydrophobicContact CB-CD1 4.16Å; E310-I313 HydrophobicContact CB-CG1 4.49Å; E310-I313 PolarHBondContact O-N 2.58Å; E310-I313 VanDerWaalsContact O-N 3.12Å; E310-V364 WeakPolarHBondContact OE2-CB 3.32Å
311	D	37.5	Very low	62.9	Low	35 Å²	35	45 Å²	45	19%	0.187	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.3	-165.3	-74	-86.1	0	0	0	115.5	V68 G70 L73 I313	V68-D311 HydrophobicContact CB-CB 3.97Å; V68-D311 VanDerWaalsContact CB-OD1 3.24Å; V68-D311 WeakPolarHBondContact CB-OD1 3.39Å; V68-D311 WeakPolarHBondContact CG1-OD1 3.45Å; V68-D311 VanDerWaalsContact O-CB 3.32Å; V68-D311 WeakPolarHBondContact O-CB 3.22Å; G70-D311 WeakPolarHBondContact CA-OD2 3.48Å; G70-D311 PolarHBondContact N-OD2 2.92Å; G70-D311 VanDerWaalsContact N-OD2 3.08Å; L73-D311 HydrophobicContact CD1-CB 4.24Å; L73-D311 VanDerWaalsContact CD1-CG 3.43Å; L73-D311 WeakPolarHBondContact CD1-OD1 3.23Å; L73-D311 WeakPolarHBondContact CG-OD1 3.43Å; D311-I313 VanDerWaalsContact C-N 3.34Å
312	D	44.1	Very low	64.2	Low	75 Å²	75	44.2 Å²	44.2	40%	0.401	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.9	-178.9	63.3	-62.2	0	0	0	114.2	T67 E310 R367	T67-D312 HydrophobicContact CG2-CB 3.96Å; E310-D312 PolarHBondContact O-N 2.93Å; E310-D312 VanDerWaalsContact O-N 3.11Å; D312-R367 PolarHBondContact O-NH1 3.04Å
313	I	55.3	Low	65.4	Low	5 Å²	5	42.3 Å²	42.3	3%	0.026	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-24.8	-169.3	-58	-174.1	0	0	0	112.3	Y304 E310 D311 D315 N318 M347 L349 V364	Y304-I313 HydrophobicContact CD1-CG2 4.41Å; Y304-I313 HydrophobicContact CE1-CG2 4.11Å; Y304-I313 WeakPolarHBondContact CE1-O 3.42Å; Y304-I313 PolarHBondContact OH-O 3.34Å; E310-I313 HydrophobicContact CB-CD1 4.16Å; E310-I313 HydrophobicContact CB-CG1 4.49Å; E310-I313 PolarHBondContact O-N 2.58Å; E310-I313 VanDerWaalsContact O-N 3.12Å; D311-I313 VanDerWaalsContact C-N 3.34Å; I313-D315 PolarHBondContact O-N 2.84Å; I313-N318 PolarHBondContact O-ND2 3.29Å; I313-N318 VanDerWaalsContact O-ND2 3.11Å; I313-M347 HydrophobicContact CG2-CE 4.29Å; I313-M347 WeakPolarHBondContact O-CE 3.46Å; I313-L349 HydrophobicContact CD1-CD1 4.16Å; I313-L349 HydrophobicContact CD1-CD2 4Å; I313-L349 HydrophobicContact CG1-CD2 4.44Å; I313-L349 HydrophobicContact CG2-CD1 3.48Å; I313-L349 VanDerWaalsContact CG2-CD1 3.48Å; I313-L349 HydrophobicContact CG2-CD2 4.27Å; I313-L349 HydrophobicContact CG2-CG 4.46Å; I313-V364 HydrophobicContact CD1-CB 4.14Å; I313-V364 HydrophobicContact CD1-CG1 4.08Å; I313-V364 HydrophobicContact CD1-CG2 3.64Å
314	V	49.3	Very low	66.2	Low	46 Å²	46	42.4 Å²	42.4	28%	0.279	23%	0.229	S	C	.	.			trans	-83	95.7	-175.8	-178.1	0	0	0	0	110.8	Y304 L309	Y304-V314 HydrophobicContact CD1-CG2 4.22Å; Y304-V314 HydrophobicContact CD2-CB 4.4Å; Y304-V314 HydrophobicContact CD2-CG1 3.94Å; Y304-V314 HydrophobicContact CD2-CG2 4.07Å; Y304-V314 HydrophobicContact CE2-CB 4.23Å; Y304-V314 HydrophobicContact CE2-CG1 3.79Å; Y304-V314 HydrophobicContact CE2-CG2 4.35Å; Y304-V314 HydrophobicContact CG-CG2 4.01Å; L309-V314 HydrophobicContact CD2-CG2 4.31Å
315	D	53.7	Low	67.4	Low	64 Å²	64	43.5 Å²	43.5	34%	0.342	24%	0.237	S	C	.	.			trans	-125.2	131.1	171.2	-178.6	-30.9	0	0	0	109.1	Y304 I313 S317 N318	Y304-D315 PolarHBondContact OH-N 3.07Å; Y304-D315 VanDerWaalsContact OH-N 3.17Å; Y304-D315 PolarHBondContact OH-O 2.83Å; I313-D315 PolarHBondContact O-N 2.84Å; D315-S317 VanDerWaalsContact C-N 3.3Å; D315-S317 VanDerWaalsContact CG-OG 3.26Å; D315-S317 PolarHBondContact O-N 2.96Å; D315-S317 WeakPolarHBondContact OD1-CA 3.5Å; D315-S317 VanDerWaalsContact OD1-CB 3.31Å; D315-S317 WeakPolarHBondContact OD1-CB 3.27Å; D315-S317 PolarHBondContact OD1-N 2.79Å; D315-S317 PolarHBondContact OD1-OG 2.78Å; D315-S317 PolarHBondContact OD2-OG 3.1Å; D315-N318 VanDerWaalsContact O-CB 3.28Å; D315-N318 WeakPolarHBondContact O-CB 3.38Å; D315-N318 PolarHBondContact O-N 2.93Å; D315-N318 PolarHBondContact O-ND2 3.16Å
316	P	48.1	Very low	68.9	Low	29 Å²	29	39.1 Å²	39.1	19%	0.188	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.7	178.9	-16.6	28.5	0	0	0	114.3	L243 R296 L297 N318	L243-P316 HydrophobicContact CD1-CB 4.49Å; L243-P316 HydrophobicContact CD1-CG 3.32Å; L243-P316 HydrophobicContact CD2-CB 3.83Å; L243-P316 HydrophobicContact CD2-CG 3.47Å; L243-P316 VanDerWaalsContact CD2-CG 3.47Å; L243-P316 HydrophobicContact CG-CG 3.97Å; R296-P316 PolarHBondContact NH1-O 3.15Å; R296-P316 PolarHBondContact NH2-O 2.71Å; L297-P316 HydrophobicContact CD2-CB 4.07Å; P316-N318 PolarHBondContact O-N 2.96Å
317	S	53.1	Low	69.5	Low	72 Å²	72	39.8 Å²	39.8	50%	0.503	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-6.6	177.6	72.7	0	0	0	0	112.9	D315 N345	D315-S317 VanDerWaalsContact C-N 3.3Å; D315-S317 VanDerWaalsContact CG-OG 3.26Å; D315-S317 PolarHBondContact O-N 2.96Å; D315-S317 WeakPolarHBondContact OD1-CA 3.5Å; D315-S317 VanDerWaalsContact OD1-CB 3.31Å; D315-S317 WeakPolarHBondContact OD1-CB 3.27Å; D315-S317 PolarHBondContact OD1-N 2.79Å; D315-S317 PolarHBondContact OD1-OG 2.78Å; D315-S317 PolarHBondContact OD2-OG 3.1Å; S317-N345 PolarHBondContact O-ND2 2.98Å
318	N	68.9	Low	70.3	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.			trans	-68.9	133.9	171.2	-65.2	-13.2	0	0	0	110.4	R296 L300 Y304 I313 D315 P316 F344 N345 N346 M347	R296-N318 PolarHBondContact NH1-O 2.91Å; L300-N318 HydrophobicContact CD1-CB 4.07Å; L300-N318 HydrophobicContact CD2-CB 4.49Å; L300-N318 WeakPolarHBondContact CD2-O 3.45Å; Y304-N318 WeakPolarHBondContact OH-CB 3.23Å; Y304-N318 PolarHBondContact OH-ND2 3.24Å; I313-N318 PolarHBondContact O-ND2 3.29Å; I313-N318 VanDerWaalsContact O-ND2 3.11Å; D315-N318 VanDerWaalsContact O-CB 3.28Å; D315-N318 WeakPolarHBondContact O-CB 3.38Å; D315-N318 PolarHBondContact O-N 2.93Å; D315-N318 PolarHBondContact O-ND2 3.16Å; P316-N318 PolarHBondContact O-N 2.96Å; N318-F344 HydrophobicContact CB-CD1 3.89Å; N318-F344 HydrophobicContact CB-CE1 4.5Å; N318-F344 HydrophobicContact CB-CG 4.45Å; N318-N345 WeakPolarHBondContact CA-OD1 3.39Å; N318-N346 PolarHBondContact OD1-ND2 3.35Å; N318-N346 PolarHBondContact OD1-OD1 2.96Å; N318-M347 WeakPolarHBondContact ND2-CE 3.27Å
319	T	78.8	Confident	71.5	Confident	51 Å²	51	39.9 Å²	39.9	31%	0.313	21%	0.214	S	C	.	.			trans	-121.7	125.6	167.4	-65.7	0	0	0	0	107.7	L321 F344 N345	T319-L321 PolarHBondContact O-N 3.3Å; T319-F344 CarbonylContact O-C 3.47Å; T319-F344 VanDerWaalsContact O-CA 3.24Å; T319-F344 WeakPolarHBondContact O-CA 3.5Å; T319-N345 PolarHBondContact N-OD1 2.94Å; T319-N345 PolarHBondContact O-N 3.33Å
320	L	86.6	Confident	72.6	Confident	55 Å²	55	40.1 Å²	40.1	29%	0.288	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	120.4	173.8	-174.9	79.5	0	0	0	108.6	V303 E323 F342 F344	V303-L320 HydrophobicContact CG1-CD1 4.43Å; V303-L320 HydrophobicContact CG2-CD2 3.83Å; L320-E323 HydrophobicContact CD1-CB 4.43Å; L320-E323 HydrophobicContact CD2-CB 4.2Å; L320-E323 HydrophobicContact CD2-CG 4.15Å; L320-F342 HydrophobicContact CD1-CB 4.08Å; L320-F342 HydrophobicContact CD1-CD1 4.19Å; L320-F344 HydrophobicContact CB-CD1 4.24Å; L320-F344 HydrophobicContact CB-CE1 4.16Å; L320-F344 HydrophobicContact CD1-CD1 4.23Å; L320-F344 HydrophobicContact CD1-CE1 3.9Å; L320-F344 HydrophobicContact CD1-CE2 4.43Å; L320-F344 HydrophobicContact CD1-CZ 4.02Å
321	L	90.3	Very high	73.6	Confident	63 Å²	63	38.6 Å²	38.6	33%	0.33	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-34.9	175.5	-59.7	-178.9	0	0	0	111.6	T319 L343 N345 A416	T319-L321 PolarHBondContact O-N 3.3Å; L321-L343 HydrophobicContact CB-CD2 4.39Å; L321-L343 HydrophobicContact CB-CG 4.3Å; L321-L343 PolarHBondContact N-O 3.29Å; L321-N345 HydrophobicContact CD1-CB 4.46Å; L321-A416 HydrophobicContact CD1-CB 3.47Å; L321-A416 VanDerWaalsContact CD1-CB 3.47Å
322	R	93.3	Very high	74.6	Confident	60 Å²	60	45.1 Å²	45.1	23%	0.226	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	145.9	-180	-169.9	174.3	176.1	100	-5.1	111.7	L343 S408 W409 A412	R322-L343 HydrophobicContact CB-CB 4.36Å; R322-L343 PolarHBondContact N-O 2.92Å; R322-L343 PolarHBondContact O-N 3.26Å; R322-S408 PolarHBondContact NH1-O 3.06Å; R322-S408 PolarHBondContact NH1-OG 2.77Å; R322-S408 PolarHBondContact NH2-OG 3.24Å; R322-W409 HydrophobicContact CB-CH2 4.28Å; R322-W409 HydrophobicContact CB-CZ3 4.01Å; R322-W409 VanDerWaalsContact CD-CE3 3.44Å; R322-W409 HydrophobicContact CG-CE3 4.16Å; R322-W409 HydrophobicContact CG-CH2 3.72Å; R322-W409 HydrophobicContact CG-CZ2 4.2Å; R322-W409 HydrophobicContact CG-CZ3 3.71Å; R322-W409 VanDerWaalsContact NE-CD2 3.27Å; R322-A412 HydrophobicContact CB-CB 4.2Å
323	E	94	Very high	75.4	Confident	64 Å²	64	49.6 Å²	49.6	30%	0.299	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	165.1	165	66.9	172.7	-151.4	0	0	111.7	R306 L320 Y340 L341 F342	R306-E323 IonicContact CZ-OE1 2.7Å; R306-E323 IonicContact CZ-OE2 3.52Å; R306-E323 IonicContact NH1-OE1 3.67Å; R306-E323 PolarHBondContact NH1-OE1 3Å; R306-E323 IonicContact NH1-OE2 2.83Å; R306-E323 PolarHBondContact NH1-OE2 3.2Å; R306-E323 IonicContact NH2-OE1 3.68Å; R306-E323 PolarHBondContact NH2-OE1 3.27Å; R306-E323 IonicContact NH2-OE2 3.4Å; R306-E323 PolarHBondContact NH2-OE2 2.96Å; L320-E323 HydrophobicContact CD1-CB 4.43Å; L320-E323 HydrophobicContact CD2-CB 4.2Å; L320-E323 HydrophobicContact CD2-CG 4.15Å; E323-Y340 HydrophobicContact CB-CE1 3.9Å; E323-Y340 HydrophobicContact CG-CE1 4.39Å; E323-Y340 PolarHBondContact OE1-OH 3.27Å; E323-L341 VanDerWaalsContact CA-O 3.26Å; E323-L341 WeakPolarHBondContact CA-O 3.11Å; E323-F342 HydrophobicContact CB-CD1 3.92Å; E323-F342 HydrophobicContact CB-CE1 4.34Å; E323-F342 WeakPolarHBondContact OE2-CD1 3.48Å; E323-F342 WeakPolarHBondContact OE2-CE1 3.49Å
324	G	93.3	Very high	75.4	Confident	7 Å²	7	53.2 Å²	53.2	7%	0.072	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.6	170.8	170.3	0	0	0	0	0	115.6	Y340 L341	G324-Y340 VanDerWaalsContact C-CD2 3.49Å; G324-Y340 VanDerWaalsContact C-CE2 3.49Å; G324-Y340 WeakPolarHBondContact O-CA 3.32Å; G324-L341 PolarHBondContact N-O 3.46Å; G324-L341 VanDerWaalsContact N-O 3.07Å; G324-L341 PolarHBondContact O-N 2.71Å
325	P	93.6	Very high	76.5	Confident	29 Å²	29	56.5 Å²	56.5	19%	0.188	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	149	177.2	31.6	-34.1	0	0	0	112	R339 Y340	P325-R339 CarbonylContact C-O 3.6Å; P325-R339 VanDerWaalsContact CA-O 3.3Å; P325-R339 WeakPolarHBondContact CA-O 3.19Å; P325-Y340 HydrophobicContact CB-CD2 4.24Å
326	V	94.1	Very high	77.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	157.8	169.5	-61.7	0	0	0	0	109.9	R339 L341 L398 W409	V326-R339 HydrophobicContact CG2-CB 4.08Å; V326-R339 PolarHBondContact N-O 2.9Å; V326-R339 CarbonylContact O-C 3.54Å; V326-R339 WeakPolarHBondContact O-CA 3.24Å; V326-R339 PolarHBondContact O-N 3.39Å; V326-R339 VanDerWaalsContact O-O 3.1Å; V326-L341 HydrophobicContact CB-CD1 4.49Å; V326-L341 HydrophobicContact CG1-CD1 3.7Å; V326-L341 HydrophobicContact CG1-CG 4.02Å; V326-L341 HydrophobicContact CG2-CD1 3.98Å; V326-L341 HydrophobicContact CG2-CD2 4.04Å; V326-L341 HydrophobicContact CG2-CG 3.68Å; V326-L398 HydrophobicContact CG2-CD2 4.08Å; V326-W409 HydrophobicContact CG1-CZ2 4.44Å
327	F	91.9	Very high	79.4	Confident	60 Å²	60	57 Å²	57	26%	0.263	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136.4	166.5	-62.8	-70.4	0	0	0	110.4	P336 E338 L398 Q399 R401	F327-P336 HydrophobicContact CB-CB 3.74Å; F327-P336 HydrophobicContact CD1-CB 4.48Å; F327-P336 HydrophobicContact CG-CB 4.32Å; F327-E338 HydrophobicContact CD1-CB 4.07Å; F327-E338 HydrophobicContact CE1-CB 3.93Å; F327-E338 HydrophobicContact CE1-CG 4.29Å; F327-L398 CarbonylContact O-C 3.44Å; F327-L398 WeakPolarHBondContact O-CA 3.48Å; F327-Q399 HydrophobicContact CB-CB 4.14Å; F327-Q399 HydrophobicContact CB-CG 4.44Å; F327-Q399 PolarHBondContact N-O 3.05Å; F327-Q399 PolarHBondContact O-N 3.42Å; F327-R401 HydrophobicContact CD2-CG 4.49Å; F327-R401 HydrophobicContact CE2-CG 3.87Å
328	K	90.6	Very high	81.1	Confident	31 Å²	31	57.8 Å²	57.8	14%	0.135	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.6	175.3	-173.2	-98.7	171.6	59.4	0	110.4	M337 R339 Y350 L398	K328-M337 PolarHBondContact N-O 2.92Å; K328-M337 PolarHBondContact O-N 3.19Å; K328-R339 HydrophobicContact CB-CG 3.73Å; K328-Y350 HydrophobicContact CB-CE2 3.9Å; K328-Y350 WeakPolarHBondContact CD-OH 3.35Å; K328-Y350 HydrophobicContact CG-CE2 3.75Å; K328-Y350 WeakPolarHBondContact CG-OH 3.42Å; K328-L398 HydrophobicContact CB-CD2 4.04Å; K328-L398 HydrophobicContact CG-CD2 4.04Å
329	I	87	Confident	82.2	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	28%	0.282	C	S	.	.			trans	-70.7	137.6	178.4	-56.7	172.6	0	0	0	108.5	F383 E397 Q399	I329-F383 HydrophobicContact CD1-CB 3.69Å; I329-F383 HydrophobicContact CD1-CD1 4.43Å; I329-F383 HydrophobicContact CD1-CD2 4.25Å; I329-F383 HydrophobicContact CD1-CG 3.85Å; I329-F383 HydrophobicContact CG1-CB 4.47Å; I329-F383 HydrophobicContact CG1-CD1 4.35Å; I329-F383 HydrophobicContact CG1-CG 4.22Å; I329-F383 HydrophobicContact CG2-CD2 4.15Å; I329-F383 HydrophobicContact CG2-CE2 4.11Å; I329-F383 HydrophobicContact CG2-CG 4.47Å; I329-F383 HydrophobicContact CG2-CZ 4.4Å; I329-E397 HydrophobicContact CB-CB 3.99Å; I329-E397 HydrophobicContact CD1-CB 4.41Å; I329-E397 PolarHBondContact N-O 3.02Å; I329-Q399 HydrophobicContact CD1-CB 4.37Å; I329-Q399 HydrophobicContact CG1-CB 4.37Å
330	S	75.4	Confident	82.9	Confident	27 Å²	27	58.7 Å²	58.7	19%	0.189	27%	0.274	C	S	.	.			trans	-112.4	120.8	-169	-176.6	0	0	0	0	112.2	R332 R333	S330-R332 PolarHBondContact O-N 3.27Å; S330-R332 PolarHBondContact OG-N 3.25Å; S330-R333 VanDerWaalsContact O-O 3.08Å; S330-R333 PolarHBondContact OG-N 2.9Å
331	F	66.4	Low	83.3	Confident	35 Å²	35	56.1 Å²	56.1	15%	0.154	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-9.2	174.5	-53	-82.2	0	0	0	114.5	E397 W455 R457 D458	F331-E397 WeakPolarHBondContact CE1-OE1 3.44Å; F331-E397 HydrophobicContact CZ-CG 4.27Å; F331-W455 HydrophobicContact CD1-CB 4.29Å; F331-W455 VanDerWaalsContact CD1-O 3.28Å; F331-W455 WeakPolarHBondContact CD1-O 3.44Å; F331-W455 HydrophobicContact CE1-CB 4.34Å; F331-W455 WeakPolarHBondContact CE1-O 3.3Å; F331-R457 HydrophobicContact CD1-CB 4.41Å; F331-R457 HydrophobicContact CD1-CG 3.74Å; F331-R457 HydrophobicContact CE1-CG 4.33Å; F331-D458 PolarHBondContact O-N 3Å
332	R	58.7	Low	83.5	Confident	173 Å²	173	53.1 Å²	53.1	65%	0.653	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-135.3	-3.4	-172.6	-62.3	-167.5	179.8	174.9	4.1	116.4	S330 D458	S330-R332 PolarHBondContact O-N 3.27Å; S330-R332 PolarHBondContact OG-N 3.25Å; R332-D458 IonicContact NE-OD2 3.46Å
333	R	60.5	Low	83.5	Confident	168 Å²	168	50.2 Å²	50.2	63%	0.634	23%	0.234	S	C	*	.			trans	-136.4	151.8	178.2	-68.8	-171.2	177.3	-167	-1.6	108.7	S330	S330-R333 VanDerWaalsContact O-O 3.08Å; S330-R333 PolarHBondContact OG-N 2.9Å
334	N	56.7	Low	83.3	Confident	81 Å²	81	47.2 Å²	47.2	43%	0.433	22%	0.219	S	C	.	.	S	Bend	trans	-73	-41.7	-177.7	-132.7	53.4	0	0	0	112.1	K459	N334-K459 WeakPolarHBondContact OD1-CE 3.45Å; N334-K459 PolarHBondContact OD1-NZ 3.17Å
335	D	71.7	Confident	82.8	Confident	115 Å²	115	48.6 Å²	48.6	62%	0.615	23%	0.225	S	C	*	.	S	Bend	trans	-86.3	129.1	-167.7	-35.5	-65.8	0	0	0	110.4	M337	D335-M337 PolarHBondContact O-N 3.02Å
336	P	78.4	Confident	81.9	Confident	41 Å²	41	48.8 Å²	48.8	27%	0.266	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-58.6	134.2	171.4	-23	34.1	0	0	0	110.5	F327 F383	F327-P336 HydrophobicContact CB-CB 3.74Å; F327-P336 HydrophobicContact CD1-CB 4.48Å; F327-P336 HydrophobicContact CG-CB 4.32Å; P336-F383 HydrophobicContact CG-CD1 3.76Å; P336-F383 HydrophobicContact CG-CE1 3.56Å
337	M	84.5	Confident	81.5	Confident	62 Å²	62	48.9 Å²	48.9	31%	0.305	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129	-178.1	-57	-168	78.8	0	0	110.4	K328 D335 R339	K328-M337 PolarHBondContact N-O 2.92Å; K328-M337 PolarHBondContact O-N 3.19Å; D335-M337 PolarHBondContact O-N 3.02Å; M337-R339 WeakPolarHBondContact O-CG 3.39Å; M337-R339 PolarHBondContact SD-NH2 2.92Å
338	E	89.1	Confident	81.6	Confident	89 Å²	89	46 Å²	46	42%	0.416	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	136.1	176.6	-172.2	168	-129.3	0	0	112.1	F327 R401	F327-E338 HydrophobicContact CD1-CB 4.07Å; F327-E338 HydrophobicContact CE1-CB 3.93Å; F327-E338 HydrophobicContact CE1-CG 4.29Å; E338-R401 IonicContact OE1-CZ 2.89Å; E338-R401 IonicContact OE1-NH2 2.67Å; E338-R401 PolarHBondContact OE1-NH2 2.95Å
339	R	92.4	Very high	81.6	Confident	34 Å²	34	44.5 Å²	44.5	13%	0.128	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	173.4	-174.7	-64.2	-65.7	178.4	-102.1	-0.2	109	P325 V326 K328 M337 Y350 C351	P325-R339 CarbonylContact C-O 3.6Å; P325-R339 VanDerWaalsContact CA-O 3.3Å; P325-R339 WeakPolarHBondContact CA-O 3.19Å; V326-R339 HydrophobicContact CG2-CB 4.08Å; V326-R339 PolarHBondContact N-O 2.9Å; V326-R339 CarbonylContact O-C 3.54Å; V326-R339 WeakPolarHBondContact O-CA 3.24Å; V326-R339 PolarHBondContact O-N 3.39Å; V326-R339 VanDerWaalsContact O-O 3.1Å; K328-R339 HydrophobicContact CB-CG 3.73Å; M337-R339 WeakPolarHBondContact O-CG 3.39Å; M337-R339 PolarHBondContact SD-NH2 2.92Å; R339-Y350 HydrophobicContact CB-CD2 4.5Å; R339-Y350 HydrophobicContact CB-CE2 3.97Å; R339-Y350 WeakPolarHBondContact CD-OH 3.19Å; R339-Y350 HydrophobicContact CG-CE2 3.6Å; R339-Y350 PolarHBondContact NE-OH 3.19Å; R339-C351 WeakPolarHBondContact CA-O 3.48Å; R339-C351 WeakPolarHBondContact CB-O 3.11Å; R339-C351 VanDerWaalsContact CD-O 3.22Å; R339-C351 WeakPolarHBondContact CD-O 3.15Å
340	Y	93.4	Very high	81.8	Confident	37 Å²	37	45.1 Å²	45.1	15%	0.145	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.7	176.3	-156.5	-88.8	0	0	0	109.3	E323 G324 P325 F342 C351 F362	E323-Y340 HydrophobicContact CB-CE1 3.9Å; E323-Y340 HydrophobicContact CG-CE1 4.39Å; E323-Y340 PolarHBondContact OE1-OH 3.27Å; G324-Y340 VanDerWaalsContact C-CD2 3.49Å; G324-Y340 VanDerWaalsContact C-CE2 3.49Å; G324-Y340 WeakPolarHBondContact O-CA 3.32Å; P325-Y340 HydrophobicContact CB-CD2 4.24Å; Y340-F342 AromaticContact CD1-CD2 3.91Å; Y340-F342 HydrophobicContact CD1-CD2 3.91Å; Y340-F342 HydrophobicContact CD1-CE1 4.32Å; Y340-F342 AromaticContact CD1-CE2 3.41Å; Y340-F342 HydrophobicContact CD1-CE2 3.41Å; Y340-F342 VanDerWaalsContact CD1-CE2 3.41Å; Y340-F342 AromaticContact CD1-CZ 3.65Å; Y340-F342 HydrophobicContact CD1-CZ 3.65Å; Y340-F342 HydrophobicContact CE1-CD1 4.33Å; Y340-F342 HydrophobicContact CE1-CD2 4.3Å; Y340-F342 AromaticContact CE1-CE1 3.83Å; Y340-F342 HydrophobicContact CE1-CE1 3.83Å; Y340-F342 AromaticContact CE1-CE2 3.79Å; Y340-F342 HydrophobicContact CE1-CE2 3.79Å; Y340-F342 AromaticContact CE1-CZ 3.53Å; Y340-F342 HydrophobicContact CE1-CZ 3.53Å; Y340-C351 PolarHBondContact N-O 3.11Å; Y340-C351 WeakPolarHBondContact O-CA 3.43Å; Y340-C351 WeakPolarHBondContact O-CB 3.38Å; Y340-C351 PolarHBondContact O-N 2.79Å; Y340-F362 VanDerWaalsContact CB-CE1 3.4Å; Y340-F362 HydrophobicContact CD1-CD1 4.26Å; Y340-F362 AromaticContact CD1-CE1 3.89Å; Y340-F362 HydrophobicContact CD1-CE1 3.89Å; Y340-F362 HydrophobicContact CD1-CE2 4.29Å; Y340-F362 AromaticContact CD1-CZ 3.89Å; Y340-F362 HydrophobicContact CD1-CZ 3.89Å; Y340-F362 AromaticContact CD2-CE1 3.57Å; Y340-F362 HydrophobicContact CD2-CE1 3.57Å; Y340-F362 AromaticContact CD2-CZ 3.68Å; Y340-F362 HydrophobicContact CD2-CZ 3.68Å; Y340-F362 HydrophobicContact CE1-CE1 4.5Å; Y340-F362 HydrophobicContact CE1-CE2 4.28Å; Y340-F362 HydrophobicContact CE1-CZ 4.05Å; Y340-F362 HydrophobicContact CE2-CE1 4.25Å; Y340-F362 AromaticContact CE2-CZ 3.88Å; Y340-F362 HydrophobicContact CE2-CZ 3.88Å; Y340-F362 AromaticContact CG-CD1 3.93Å; Y340-F362 HydrophobicContact CG-CD1 3.93Å; Y340-F362 AromaticContact CG-CE1 3.35Å; Y340-F362 HydrophobicContact CG-CE1 3.35Å; Y340-F362 HydrophobicContact CG-CE2 4.5Å; Y340-F362 AromaticContact CG-CZ 3.68Å; Y340-F362 HydrophobicContact CG-CZ 3.68Å
341	L	94.8	Very high	82.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.8	178.7	-60.3	-175.1	0	0	0	110.2	E323 G324 V326 L348 L349 Y350 L398 W409 F413	E323-L341 VanDerWaalsContact CA-O 3.26Å; E323-L341 WeakPolarHBondContact CA-O 3.11Å; G324-L341 PolarHBondContact N-O 3.46Å; G324-L341 VanDerWaalsContact N-O 3.07Å; G324-L341 PolarHBondContact O-N 2.71Å; V326-L341 HydrophobicContact CB-CD1 4.49Å; V326-L341 HydrophobicContact CG1-CD1 3.7Å; V326-L341 HydrophobicContact CG1-CG 4.02Å; V326-L341 HydrophobicContact CG2-CD1 3.98Å; V326-L341 HydrophobicContact CG2-CD2 4.04Å; V326-L341 HydrophobicContact CG2-CG 3.68Å; L341-L348 HydrophobicContact CB-CD1 4.06Å; L341-L348 HydrophobicContact CD1-CD1 4.36Å; L341-L348 HydrophobicContact CD2-CD1 4.24Å; L341-L348 HydrophobicContact CG-CD1 4.45Å; L341-L349 WeakPolarHBondContact CA-O 3.36Å; L341-Y350 HydrophobicContact CD2-CD2 3.99Å; L341-L398 HydrophobicContact CD1-CD1 4.09Å; L341-W409 HydrophobicContact CB-CH2 3.55Å; L341-W409 HydrophobicContact CB-CZ2 4.04Å; L341-W409 HydrophobicContact CB-CZ3 4.1Å; L341-W409 HydrophobicContact CD1-CD2 4.48Å; L341-W409 HydrophobicContact CD1-CE3 4.27Å; L341-W409 HydrophobicContact CD1-CH2 4.11Å; L341-W409 HydrophobicContact CD1-CZ2 4.28Å; L341-W409 HydrophobicContact CD1-CZ3 4.09Å; L341-W409 HydrophobicContact CG-CH2 4.4Å; L341-F413 HydrophobicContact CD1-CZ 3.93Å
342	F	93.3	Very high	83.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	115.8	163.3	-59	-100.7	0	0	0	107.3	V303 L307 L320 E323 Y340 F344 L349 C351 F362	V303-F342 HydrophobicContact CG1-CD1 3.67Å; V303-F342 HydrophobicContact CG1-CE1 3.94Å; L307-F342 HydrophobicContact CD1-CD2 4.5Å; L307-F342 HydrophobicContact CD1-CG 4.38Å; L307-F342 HydrophobicContact CD2-CD2 3.51Å; L307-F342 HydrophobicContact CD2-CE2 3.46Å; L307-F342 VanDerWaalsContact CD2-CE2 3.46Å; L307-F342 HydrophobicContact CD2-CG 4.19Å; L307-F342 HydrophobicContact CD2-CZ 4.1Å; L307-F342 HydrophobicContact CG-CD2 4.17Å; L307-F342 HydrophobicContact CG-CE1 4.42Å; L307-F342 HydrophobicContact CG-CE2 3.98Å; L307-F342 HydrophobicContact CG-CG 4.47Å; L307-F342 HydrophobicContact CG-CZ 4.11Å; L320-F342 HydrophobicContact CD1-CB 4.08Å; L320-F342 HydrophobicContact CD1-CD1 4.19Å; E323-F342 HydrophobicContact CB-CD1 3.92Å; E323-F342 HydrophobicContact CB-CE1 4.34Å; E323-F342 WeakPolarHBondContact OE2-CD1 3.48Å; E323-F342 WeakPolarHBondContact OE2-CE1 3.49Å; Y340-F342 AromaticContact CD1-CD2 3.91Å; Y340-F342 HydrophobicContact CD1-CD2 3.91Å; Y340-F342 HydrophobicContact CD1-CE1 4.32Å; Y340-F342 AromaticContact CD1-CE2 3.41Å; Y340-F342 HydrophobicContact CD1-CE2 3.41Å; Y340-F342 VanDerWaalsContact CD1-CE2 3.41Å; Y340-F342 AromaticContact CD1-CZ 3.65Å; Y340-F342 HydrophobicContact CD1-CZ 3.65Å; Y340-F342 HydrophobicContact CE1-CD1 4.33Å; Y340-F342 HydrophobicContact CE1-CD2 4.3Å; Y340-F342 AromaticContact CE1-CE1 3.83Å; Y340-F342 HydrophobicContact CE1-CE1 3.83Å; Y340-F342 AromaticContact CE1-CE2 3.79Å; Y340-F342 HydrophobicContact CE1-CE2 3.79Å; Y340-F342 AromaticContact CE1-CZ 3.53Å; Y340-F342 HydrophobicContact CE1-CZ 3.53Å; F342-F344 HydrophobicContact CB-CD2 4.5Å; F342-F344 HydrophobicContact CB-CE2 3.71Å; F342-F344 HydrophobicContact CB-CZ 4.19Å; F342-L349 HydrophobicContact CB-CB 4.3Å; F342-L349 PolarHBondContact N-O 2.74Å; F342-L349 PolarHBondContact O-N 3.22Å; F342-C351 HydrophobicContact CE2-CB 4.5Å; F342-F362 HydrophobicContact CE2-CB 4.26Å; F342-F362 AromaticContact CE2-CD2 3.86Å; F342-F362 HydrophobicContact CE2-CD2 3.86Å; F342-F362 HydrophobicContact CE2-CE2 4.41Å; F342-F362 AromaticContact CE2-CG 3.98Å; F342-F362 HydrophobicContact CE2-CG 3.98Å; F342-F362 AromaticContact CZ-CD2 3.54Å; F342-F362 HydrophobicContact CZ-CD2 3.54Å; F342-F362 AromaticContact CZ-CE2 3.84Å; F342-F362 HydrophobicContact CZ-CE2 3.84Å; F342-F362 HydrophobicContact CZ-CG 4.14Å
343	L	94.3	Very high	84.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.9	176.1	176.4	64.4	0	0	0	108.8	L321 R322 L348 V370 W409 A412 F413 A416	L321-L343 HydrophobicContact CB-CD2 4.39Å; L321-L343 HydrophobicContact CB-CG 4.3Å; L321-L343 PolarHBondContact N-O 3.29Å; R322-L343 HydrophobicContact CB-CB 4.36Å; R322-L343 PolarHBondContact N-O 2.92Å; R322-L343 PolarHBondContact O-N 3.26Å; L343-L348 HydrophobicContact CB-CD1 4.27Å; L343-L348 HydrophobicContact CD1-CB 4.23Å; L343-L348 HydrophobicContact CD1-CD1 4.5Å; L343-V370 HydrophobicContact CD1-CG2 3.86Å; L343-W409 HydrophobicContact CB-CZ3 4.29Å; L343-A412 HydrophobicContact CD2-CB 4Å; L343-A412 WeakPolarHBondContact CD2-O 3.22Å; L343-F413 HydrophobicContact CB-CE1 4.39Å; L343-F413 HydrophobicContact CD1-CD1 3.8Å; L343-F413 HydrophobicContact CD1-CE1 4.01Å; L343-F413 HydrophobicContact CD2-CD1 3.61Å; L343-F413 HydrophobicContact CD2-CE1 3.94Å; L343-F413 HydrophobicContact CD2-CG 4.41Å; L343-F413 HydrophobicContact CG-CD1 4.25Å; L343-F413 HydrophobicContact CG-CE1 4.34Å; L343-A416 HydrophobicContact CD1-CB 4.34Å; L343-A416 HydrophobicContact CD2-CB 4.33Å
344	F	89.1	Confident	85.6	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	166.5	171.3	-58.2	-90.6	0	0	0	110.3	L300 V303 Y304 L307 N318 T319 L320 F342 N346 M347 L349	L300-F344 HydrophobicContact CD1-CD1 4.23Å; L300-F344 HydrophobicContact CD1-CE1 3.71Å; V303-F344 HydrophobicContact CG1-CE1 4.05Å; V303-F344 HydrophobicContact CG1-CZ 3.61Å; Y304-F344 HydrophobicContact CE1-CE1 4.44Å; Y304-F344 HydrophobicContact CE1-CZ 4.3Å; L307-F344 HydrophobicContact CD1-CZ 4.23Å; N318-F344 HydrophobicContact CB-CD1 3.89Å; N318-F344 HydrophobicContact CB-CE1 4.5Å; N318-F344 HydrophobicContact CB-CG 4.45Å; T319-F344 CarbonylContact O-C 3.47Å; T319-F344 VanDerWaalsContact O-CA 3.24Å; T319-F344 WeakPolarHBondContact O-CA 3.5Å; L320-F344 HydrophobicContact CB-CD1 4.24Å; L320-F344 HydrophobicContact CB-CE1 4.16Å; L320-F344 HydrophobicContact CD1-CD1 4.23Å; L320-F344 HydrophobicContact CD1-CE1 3.9Å; L320-F344 HydrophobicContact CD1-CE2 4.43Å; L320-F344 HydrophobicContact CD1-CZ 4.02Å; F342-F344 HydrophobicContact CB-CD2 4.5Å; F342-F344 HydrophobicContact CB-CE2 3.71Å; F342-F344 HydrophobicContact CB-CZ 4.19Å; F344-N346 PolarHBondContact O-N 3.04Å; F344-N346 VanDerWaalsContact O-N 3.08Å; F344-M347 HydrophobicContact CB-CG 4.34Å; F344-M347 HydrophobicContact CD2-CG 4.06Å; F344-M347 PolarHBondContact N-O 3.07Å; F344-L349 HydrophobicContact CD2-CD1 4.46Å; F344-L349 HydrophobicContact CD2-CG 4.38Å; F344-L349 HydrophobicContact CE2-CD1 3.63Å; F344-L349 HydrophobicContact CE2-CG 3.97Å; F344-L349 HydrophobicContact CZ-CD1 4.43Å
345	N	82.3	Confident	85.8	Confident	36 Å²	36	38.7 Å²	38.7	19%	0.193	20%	0.2	C	C	.	.	S	Bend	trans	-55.4	-15.9	172.4	62.1	-22.5	0	0	0	115.8	S317 N318 T319 L321 I420	S317-N345 PolarHBondContact O-ND2 2.98Å; N318-N345 WeakPolarHBondContact CA-OD1 3.39Å; T319-N345 PolarHBondContact N-OD1 2.94Å; T319-N345 PolarHBondContact O-N 3.33Å; L321-N345 HydrophobicContact CD1-CB 4.46Å; N345-I420 WeakPolarHBondContact O-CD1 3.39Å; N345-I420 WeakPolarHBondContact O-CG1 3.22Å
346	N	74.5	Confident	85	Confident	33 Å²	33	37.6 Å²	37.6	18%	0.176	19%	0.193	C	C	.	.	S	Bend	trans	-124.3	-23.6	177.6	62	2.4	0	0	0	115	N318 F344 V370	N318-N346 PolarHBondContact OD1-ND2 3.35Å; N318-N346 PolarHBondContact OD1-OD1 2.96Å; F344-N346 PolarHBondContact O-N 3.04Å; F344-N346 VanDerWaalsContact O-N 3.08Å; N346-V370 PolarHBondContact O-N 3.06Å
347	M	87.1	Confident	83.5	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	154.2	-173.8	70.4	-179.7	135.4	0	0	113.9	I313 N318 F344 L349 R367 I368	I313-M347 HydrophobicContact CG2-CE 4.29Å; I313-M347 WeakPolarHBondContact O-CE 3.46Å; N318-M347 WeakPolarHBondContact ND2-CE 3.27Å; F344-M347 HydrophobicContact CB-CG 4.34Å; F344-M347 HydrophobicContact CD2-CG 4.06Å; F344-M347 PolarHBondContact N-O 3.07Å; M347-L349 HydrophobicContact CG-CD2 4.29Å; M347-L349 HydrophobicContact SD-CD2 3.77Å; M347-R367 HydrophobicContact CB-CG 4.27Å; M347-R367 HydrophobicContact SD-CG 4.07Å; M347-R367 PolarHBondContact SD-NH1 3.3Å; M347-I368 CarbonylContact C-O 3.39Å; M347-I368 WeakPolarHBondContact CA-O 3.34Å
348	L	92.8	Very high	81.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.2	168	173.2	59.6	0	0	0	110	L341 L343 I368 M373 V389 F413	L341-L348 HydrophobicContact CB-CD1 4.06Å; L341-L348 HydrophobicContact CD1-CD1 4.36Å; L341-L348 HydrophobicContact CD2-CD1 4.24Å; L341-L348 HydrophobicContact CG-CD1 4.45Å; L343-L348 HydrophobicContact CB-CD1 4.27Å; L343-L348 HydrophobicContact CD1-CB 4.23Å; L343-L348 HydrophobicContact CD1-CD1 4.5Å; L348-I368 HydrophobicContact CB-CB 4.47Å; L348-I368 PolarHBondContact N-O 3.06Å; L348-I368 PolarHBondContact O-N 2.93Å; L348-M373 HydrophobicContact CB-CE 3.72Å; L348-M373 HydrophobicContact CD2-CE 4.1Å; L348-V389 HydrophobicContact CD2-CG1 3.81Å; L348-F413 HydrophobicContact CD1-CE1 3.87Å; L348-F413 HydrophobicContact CD1-CZ 4.44Å; L348-F413 HydrophobicContact CD2-CD1 4.45Å; L348-F413 HydrophobicContact CD2-CE1 3.65Å; L348-F413 HydrophobicContact CD2-CZ 4.13Å; L348-F413 HydrophobicContact CG-CE1 4.29Å
349	L	90.9	Very high	79.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.1	170.7	-53	-178.6	0	0	0	110.2	L307 I313 L341 F342 F344 M347 V364 R367	L307-L349 HydrophobicContact CD1-CD1 3.54Å; L307-L349 HydrophobicContact CD2-CD1 3.79Å; L307-L349 HydrophobicContact CG-CD1 4.33Å; I313-L349 HydrophobicContact CD1-CD1 4.16Å; I313-L349 HydrophobicContact CD1-CD2 4Å; I313-L349 HydrophobicContact CG1-CD2 4.44Å; I313-L349 HydrophobicContact CG2-CD1 3.48Å; I313-L349 VanDerWaalsContact CG2-CD1 3.48Å; I313-L349 HydrophobicContact CG2-CD2 4.27Å; I313-L349 HydrophobicContact CG2-CG 4.46Å; L341-L349 WeakPolarHBondContact CA-O 3.36Å; F342-L349 HydrophobicContact CB-CB 4.3Å; F342-L349 PolarHBondContact N-O 2.74Å; F342-L349 PolarHBondContact O-N 3.22Å; F344-L349 HydrophobicContact CD2-CD1 4.46Å; F344-L349 HydrophobicContact CD2-CG 4.38Å; F344-L349 HydrophobicContact CE2-CD1 3.63Å; F344-L349 HydrophobicContact CE2-CG 3.97Å; F344-L349 HydrophobicContact CZ-CD1 4.43Å; M347-L349 HydrophobicContact CG-CD2 4.29Å; M347-L349 HydrophobicContact SD-CD2 3.77Å; L349-V364 HydrophobicContact CB-CG1 4.46Å; L349-V364 HydrophobicContact CD1-CG2 4.32Å; L349-V364 HydrophobicContact CD2-CG1 4.28Å; L349-R367 HydrophobicContact CD2-CB 4.14Å; L349-R367 HydrophobicContact CD2-CG 4.23Å
350	Y	90.9	Very high	78.4	Confident	15 Å²	15	44 Å²	44	6%	0.059	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.4	172.8	159.3	-90	0	0	0	110	K328 R339 L341 R365 T366 L396 L398	K328-Y350 HydrophobicContact CB-CE2 3.9Å; K328-Y350 WeakPolarHBondContact CD-OH 3.35Å; K328-Y350 HydrophobicContact CG-CE2 3.75Å; K328-Y350 WeakPolarHBondContact CG-OH 3.42Å; R339-Y350 HydrophobicContact CB-CD2 4.5Å; R339-Y350 HydrophobicContact CB-CE2 3.97Å; R339-Y350 WeakPolarHBondContact CD-OH 3.19Å; R339-Y350 HydrophobicContact CG-CE2 3.6Å; R339-Y350 PolarHBondContact NE-OH 3.19Å; L341-Y350 HydrophobicContact CD2-CD2 3.99Å; Y350-R365 HydrophobicContact CD1-CB 3.9Å; Y350-R365 HydrophobicContact CE1-CB 3.83Å; Y350-R365 PolarHBondContact O-N 2.72Å; Y350-T366 PolarHBondContact N-O 2.93Å; Y350-T366 PolarHBondContact O-N 2.74Å; Y350-L396 HydrophobicContact CD2-CD1 3.77Å; Y350-L396 HydrophobicContact CD2-CD2 4.43Å; Y350-L396 HydrophobicContact CE2-CD2 4.49Å; Y350-L396 HydrophobicContact CG-CD1 3.75Å; Y350-L396 HydrophobicContact CG-CD2 4.44Å; Y350-L398 HydrophobicContact CE2-CD2 4.45Å
351	C	90.5	Very high	77.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	156.8	-163.7	-54.8	0	0	0	0	113.9	R339 Y340 F342 F362 Q363	R339-C351 WeakPolarHBondContact CA-O 3.48Å; R339-C351 WeakPolarHBondContact CB-O 3.11Å; R339-C351 VanDerWaalsContact CD-O 3.22Å; R339-C351 WeakPolarHBondContact CD-O 3.15Å; Y340-C351 PolarHBondContact N-O 3.11Å; Y340-C351 WeakPolarHBondContact O-CA 3.43Å; Y340-C351 WeakPolarHBondContact O-CB 3.38Å; Y340-C351 PolarHBondContact O-N 2.79Å; F342-C351 HydrophobicContact CE2-CB 4.5Å; C351-F362 HydrophobicContact CB-CB 4.06Å; C351-Q363 CarbonylContact C-O 3.55Å; C351-Q363 VanDerWaalsContact CA-O 3.23Å; C351-Q363 WeakPolarHBondContact CA-O 3.41Å
352	V	88.3	Confident	77.2	Confident	27 Å²	27	47.6 Å²	47.6	16%	0.164	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.8	173.1	172.5	0	0	0	0	108.9	F362 Q363 R365	V352-F362 CarbonylContact O-C 3.55Å; V352-F362 WeakPolarHBondContact O-CA 3.09Å; V352-Q363 PolarHBondContact N-O 3.19Å; V352-Q363 PolarHBondContact O-N 2.9Å; V352-R365 HydrophobicContact CB-CG 4.29Å; V352-R365 HydrophobicContact CG2-CG 3.53Å
353	P	83.8	Confident	76.7	Confident	54 Å²	54	50.1 Å²	50.1	35%	0.351	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	141.6	171.9	-23.1	33.3	0	0	0	112.4	F362	P353-F362 HydrophobicContact CB-CD1 4.37Å; P353-F362 HydrophobicContact CB-CE1 4.3Å; P353-F362 HydrophobicContact CG-CD1 4.32Å; P353-F362 HydrophobicContact CG-CE1 4.17Å
354	R	79.4	Confident	76.3	Confident	109 Å²	109	51 Å²	51	41%	0.411	27%	0.273	S	S	.	.			trans	-109	133.2	171.5	-63.1	-172	-175.4	-124.4	8.7	109.5	I356 A360 Q361 Q363	R354-I356 HydrophobicContact CB-CD1 3.98Å; R354-I356 HydrophobicContact CB-CG1 3.75Å; R354-I356 PolarHBondContact O-N 2.88Å; R354-I356 VanDerWaalsContact O-N 3.15Å; R354-A360 WeakPolarHBondContact CD-O 3.13Å; R354-Q361 PolarHBondContact N-O 3.34Å; R354-Q363 HydrophobicContact CG-CB 4.37Å
355	V	60.4	Low	76.1	Confident	158 Å²	158	57.9 Å²	57.9	96%	0.958	30%	0.299	S	S	*	.			trans	-82.5	92.2	174.3	-174.4	0	0	0	0	108.9
356	I	55.7	Low	76.3	Confident	92 Å²	92	57.3 Å²	57.3	47%	0.472	30%	0.297	S	S	.	.			trans	-147.7	141.4	174.9	-5.1	175.1	0	0	0	109.9	R354 A360	R354-I356 HydrophobicContact CB-CD1 3.98Å; R354-I356 HydrophobicContact CB-CG1 3.75Å; R354-I356 PolarHBondContact O-N 2.88Å; R354-I356 VanDerWaalsContact O-N 3.15Å; I356-A360 WeakPolarHBondContact CD1-O 3.49Å
357	Q	46	Very low	76.8	Confident	204 Å²	204	59.6 Å²	59.6	95%	0.953	30%	0.303	S	S	*	.	S	Bend	trans	-78.3	-18.6	175.3	-70.8	176.7	-61.9	0	0	113.5
358	V	44.4	Very low	76.8	Confident	116 Å²	116	59.5 Å²	59.5	70%	0.703	30%	0.302	S	S	*	.	S	Bend	trans	-142.8	131.3	-178.8	-175.6	0	0	0	0	110.2
359	G	53.6	Low	76.4	Confident	30 Å²	30	61.4 Å²	61.4	31%	0.309	31%	0.313	S	S	.	.	S	Bend	trans	111.6	-153.9	175.1	0	0	0	0	0	114	Q361	G359-Q361 PolarHBondContact O-N 2.94Å; G359-Q361 VanDerWaalsContact O-N 3.1Å
360	A	60.8	Low	76.2	Confident	11 Å²	11	61.5 Å²	61.5	9%	0.091	31%	0.313	C	S	.	.			trans	-64	111	-176.8	0	0	0	0	0	110.1	R306 G308 R354 I356 F362	R306-A360 CarbonylContact O-C 3.59Å; G308-A360 VanDerWaalsContact CA-CB 3.44Å; R354-A360 WeakPolarHBondContact CD-O 3.13Å; I356-A360 WeakPolarHBondContact CD1-O 3.49Å; A360-F362 VanDerWaalsContact C-N 3.25Å
361	Q	78.4	Confident	75.6	Confident	95 Å²	95	62.3 Å²	62.3	44%	0.444	32%	0.323	S	S	.	.	S	Bend	trans	-73	-23.2	179.7	-63.6	177.6	3.7	0	0	111.6	R306 R354 G359	R306-Q361 HydrophobicContact CB-CB 4.48Å; R306-Q361 HydrophobicContact CG-CG 4.41Å; R306-Q361 PolarHBondContact O-N 2.88Å; R354-Q361 PolarHBondContact N-O 3.34Å; G359-Q361 PolarHBondContact O-N 2.94Å; G359-Q361 VanDerWaalsContact O-N 3.1Å
362	F	84.6	Confident	74.9	Confident	17 Å²	17	63.7 Å²	63.7	8%	0.075	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	160	-177.7	-57.9	-76.4	0	0	0	111.5	R306 Y340 F342 C351 V352 P353 A360	R306-F362 HydrophobicContact CB-CD2 4.12Å; R306-F362 HydrophobicContact CB-CE2 4.36Å; R306-F362 PolarHBondContact O-N 2.82Å; Y340-F362 VanDerWaalsContact CB-CE1 3.4Å; Y340-F362 HydrophobicContact CD1-CD1 4.26Å; Y340-F362 AromaticContact CD1-CE1 3.89Å; Y340-F362 HydrophobicContact CD1-CE1 3.89Å; Y340-F362 HydrophobicContact CD1-CE2 4.29Å; Y340-F362 AromaticContact CD1-CZ 3.89Å; Y340-F362 HydrophobicContact CD1-CZ 3.89Å; Y340-F362 AromaticContact CD2-CE1 3.57Å; Y340-F362 HydrophobicContact CD2-CE1 3.57Å; Y340-F362 AromaticContact CD2-CZ 3.68Å; Y340-F362 HydrophobicContact CD2-CZ 3.68Å; Y340-F362 HydrophobicContact CE1-CE1 4.5Å; Y340-F362 HydrophobicContact CE1-CE2 4.28Å; Y340-F362 HydrophobicContact CE1-CZ 4.05Å; Y340-F362 HydrophobicContact CE2-CE1 4.25Å; Y340-F362 AromaticContact CE2-CZ 3.88Å; Y340-F362 HydrophobicContact CE2-CZ 3.88Å; Y340-F362 AromaticContact CG-CD1 3.93Å; Y340-F362 HydrophobicContact CG-CD1 3.93Å; Y340-F362 AromaticContact CG-CE1 3.35Å; Y340-F362 HydrophobicContact CG-CE1 3.35Å; Y340-F362 HydrophobicContact CG-CE2 4.5Å; Y340-F362 AromaticContact CG-CZ 3.68Å; Y340-F362 HydrophobicContact CG-CZ 3.68Å; F342-F362 HydrophobicContact CE2-CB 4.26Å; F342-F362 AromaticContact CE2-CD2 3.86Å; F342-F362 HydrophobicContact CE2-CD2 3.86Å; F342-F362 HydrophobicContact CE2-CE2 4.41Å; F342-F362 AromaticContact CE2-CG 3.98Å; F342-F362 HydrophobicContact CE2-CG 3.98Å; F342-F362 AromaticContact CZ-CD2 3.54Å; F342-F362 HydrophobicContact CZ-CD2 3.54Å; F342-F362 AromaticContact CZ-CE2 3.84Å; F342-F362 HydrophobicContact CZ-CE2 3.84Å; F342-F362 HydrophobicContact CZ-CG 4.14Å; C351-F362 HydrophobicContact CB-CB 4.06Å; V352-F362 CarbonylContact O-C 3.55Å; V352-F362 WeakPolarHBondContact O-CA 3.09Å; P353-F362 HydrophobicContact CB-CD1 4.37Å; P353-F362 HydrophobicContact CB-CE1 4.3Å; P353-F362 HydrophobicContact CG-CD1 4.32Å; P353-F362 HydrophobicContact CG-CE1 4.17Å; A360-F362 VanDerWaalsContact C-N 3.25Å
363	Q	83.8	Confident	74.9	Confident	53 Å²	53	62.7 Å²	62.7	25%	0.248	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.6	167.3	-172.9	-175	20.7	0	0	108.5	C351 V352 R354	C351-Q363 CarbonylContact C-O 3.55Å; C351-Q363 VanDerWaalsContact CA-O 3.23Å; C351-Q363 WeakPolarHBondContact CA-O 3.41Å; V352-Q363 PolarHBondContact N-O 3.19Å; V352-Q363 PolarHBondContact O-N 2.9Å; R354-Q363 HydrophobicContact CG-CB 4.37Å
364	V	85.3	Confident	75.1	Confident	18 Å²	18	65.4 Å²	65.4	11%	0.109	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	136.4	172.4	-173.1	0	0	0	0	109.3	L307 E310 I313 L349	L307-V364 HydrophobicContact CD2-CG2 3.74Å; E310-V364 WeakPolarHBondContact OE2-CB 3.32Å; I313-V364 HydrophobicContact CD1-CB 4.14Å; I313-V364 HydrophobicContact CD1-CG1 4.08Å; I313-V364 HydrophobicContact CD1-CG2 3.64Å; L349-V364 HydrophobicContact CB-CG1 4.46Å; L349-V364 HydrophobicContact CD1-CG2 4.32Å; L349-V364 HydrophobicContact CD2-CG1 4.28Å
365	R	85.6	Confident	75.6	Confident	145 Å²	145	61.9 Å²	61.9	55%	0.547	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	-17.9	175.9	-67.4	-57	-173.2	121.3	-5.1	112.8	Y350 V352	Y350-R365 HydrophobicContact CD1-CB 3.9Å; Y350-R365 HydrophobicContact CE1-CB 3.83Å; Y350-R365 PolarHBondContact O-N 2.72Å; V352-R365 HydrophobicContact CB-CG 4.29Å; V352-R365 HydrophobicContact CG2-CG 3.53Å
366	T	84.8	Confident	77.1	Confident	25 Å²	25	61.8 Å²	61.8	15%	0.153	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	126.5	178.9	-61	0	0	0	0	108.1	Y350 I368 R394	Y350-T366 PolarHBondContact N-O 2.93Å; Y350-T366 PolarHBondContact O-N 2.74Å; T366-I368 HydrophobicContact CG2-CD1 4.1Å; T366-I368 HydrophobicContact CG2-CG1 3.55Å; T366-R394 HydrophobicContact CG2-CB 3.69Å; T366-R394 HydrophobicContact CG2-CG 3.39Å
367	R	85.4	Confident	78.7	Confident	80 Å²	80	61.1 Å²	61.1	30%	0.302	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	139.7	155.6	175.5	179.7	169.3	146	5	108.5	D312 M347 L349 D369	D312-R367 PolarHBondContact O-NH1 3.04Å; M347-R367 HydrophobicContact CB-CG 4.27Å; M347-R367 HydrophobicContact SD-CG 4.07Å; M347-R367 PolarHBondContact SD-NH1 3.3Å; L349-R367 HydrophobicContact CD2-CB 4.14Å; L349-R367 HydrophobicContact CD2-CG 4.23Å; R367-D369 IonicContact CZ-OD1 3.99Å; R367-D369 IonicContact NE-OD1 2.64Å; R367-D369 PolarHBondContact NE-OD1 3.15Å; R367-D369 IonicContact NH2-OD1 3.41Å; R367-D369 PolarHBondContact NH2-OD1 2.73Å
368	I	87.4	Confident	80.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	122	170.9	-49.5	-177.2	0	0	0	106.5	M347 L348 T366 M373 G391 R394 L396	M347-I368 CarbonylContact C-O 3.39Å; M347-I368 WeakPolarHBondContact CA-O 3.34Å; L348-I368 HydrophobicContact CB-CB 4.47Å; L348-I368 PolarHBondContact N-O 3.06Å; L348-I368 PolarHBondContact O-N 2.93Å; T366-I368 HydrophobicContact CG2-CD1 4.1Å; T366-I368 HydrophobicContact CG2-CG1 3.55Å; I368-M373 HydrophobicContact CB-CE 4.07Å; I368-M373 HydrophobicContact CG2-CE 3.74Å; I368-G391 VanDerWaalsContact CG2-CA 3.5Å; I368-R394 HydrophobicContact CD1-CB 4.06Å; I368-R394 HydrophobicContact CG1-CB 4.26Å; I368-L396 HydrophobicContact CD1-CD1 3.66Å; I368-L396 HydrophobicContact CD1-CG 3.99Å
369	D	83.6	Confident	82.2	Confident	41 Å²	41	55.4 Å²	55.4	22%	0.219	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	143.6	175.6	-57.6	-41.5	0	0	0	110.2	R367 A371 Q393	R367-D369 IonicContact CZ-OD1 3.99Å; R367-D369 IonicContact NE-OD1 2.64Å; R367-D369 PolarHBondContact NE-OD1 3.15Å; R367-D369 IonicContact NH2-OD1 3.41Å; R367-D369 PolarHBondContact NH2-OD1 2.73Å; D369-A371 VanDerWaalsContact C-N 3.29Å; D369-A371 PolarHBondContact O-N 3.37Å; D369-Q393 VanDerWaalsContact N-OE1 3.07Å; D369-Q393 PolarHBondContact OD2-NE2 2.93Å
370	V	87.4	Confident	83.3	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	27%	0.268	C	S	.	.	S	Bend	trans	-73.3	-23.7	-179.5	173.8	0	0	0	0	111.4	L343 N346 G372 M373 A416 V417 I420	L343-V370 HydrophobicContact CD1-CG2 3.86Å; N346-V370 PolarHBondContact O-N 3.06Å; V370-G372 PolarHBondContact O-N 3.1Å; V370-M373 HydrophobicContact CB-CE 4.5Å; V370-M373 HydrophobicContact CG2-CE 3.93Å; V370-M373 HydrophobicContact CG2-SD 4.44Å; V370-M373 WeakPolarHBondContact O-CB 3.18Å; V370-M373 PolarHBondContact O-N 3.14Å; V370-A416 HydrophobicContact CG1-CB 3.8Å; V370-V417 HydrophobicContact CG1-CB 4.43Å; V370-V417 HydrophobicContact CG1-CG2 3.75Å; V370-I420 HydrophobicContact CB-CD1 3.59Å; V370-I420 HydrophobicContact CG1-CD1 3.65Å; V370-I420 HydrophobicContact CG1-CG1 4.47Å
371	A	78.4	Confident	83.8	Confident	32 Å²	32	60.5 Å²	60.5	26%	0.264	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	103.6	177.5	0	0	0	0	0	112.7	D369 K392 I420	D369-A371 VanDerWaalsContact C-N 3.29Å; D369-A371 PolarHBondContact O-N 3.37Å; A371-K392 VanDerWaalsContact O-CE 3.22Å; A371-K392 WeakPolarHBondContact O-CE 3.47Å; A371-K392 PolarHBondContact O-NZ 3.3Å; A371-I420 HydrophobicContact CB-CD1 4.44Å; A371-I420 HydrophobicContact CB-CG2 4.08Å
372	G	76.4	Confident	83.8	Confident	29 Å²	29	61 Å²	61	30%	0.299	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	18.6	-173.1	0	0	0	0	0	114	V370 R451	V370-G372 PolarHBondContact O-N 3.1Å; G372-R451 PolarHBondContact O-NH1 2.84Å; G372-R451 VanDerWaalsContact O-NH1 3.08Å; G372-R451 PolarHBondContact O-NH2 3.18Å
373	M	88.3	Confident	83.7	Confident	7 Å²	7	61 Å²	61	3%	0.034	31%	0.309	C	S	.	.			trans	-70.1	128	168.5	-174	179.8	-72.5	0	0	109.5	L348 I368 V370 V375 V389 S390 F413 V417	L348-M373 HydrophobicContact CB-CE 3.72Å; L348-M373 HydrophobicContact CD2-CE 4.1Å; I368-M373 HydrophobicContact CB-CE 4.07Å; I368-M373 HydrophobicContact CG2-CE 3.74Å; V370-M373 HydrophobicContact CB-CE 4.5Å; V370-M373 HydrophobicContact CG2-CE 3.93Å; V370-M373 HydrophobicContact CG2-SD 4.44Å; V370-M373 WeakPolarHBondContact O-CB 3.18Å; V370-M373 PolarHBondContact O-N 3.14Å; M373-V375 HydrophobicContact CG-CG2 4.33Å; M373-V389 HydrophobicContact CE-CG1 4.17Å; M373-V389 HydrophobicContact CG-CG1 3.95Å; M373-V389 HydrophobicContact SD-CG1 3.61Å; M373-S390 CarbonylContact C-O 3.35Å; M373-S390 VanDerWaalsContact CA-O 3.26Å; M373-S390 WeakPolarHBondContact CA-O 3.41Å; M373-F413 HydrophobicContact SD-CD1 4.24Å; M373-V417 HydrophobicContact CB-CG2 4.04Å
374	K	87.5	Confident	83.8	Confident	111 Å²	111	61.8 Å²	61.8	48%	0.483	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.5	173.4	-63.9	-162.9	173.6	-164.2	0	108.2	S390 E440	K374-S390 PolarHBondContact N-O 2.81Å; K374-S390 PolarHBondContact O-N 3.41Å; K374-E440 IonicContact NZ-OE1 3.6Å; K374-E440 PolarHBondContact NZ-OE1 3.13Å
375	V	90.8	Very high	84.1	Confident	34 Å²	34	64.1 Å²	64.1	21%	0.206	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138	178.8	-178.9	0	0	0	0	108.9	M373 L388 V389 M410 F413	M373-V375 HydrophobicContact CG-CG2 4.33Å; V375-L388 WeakPolarHBondContact CA-O 3.31Å; V375-V389 HydrophobicContact CG2-CG1 4.42Å; V375-V389 HydrophobicContact CG2-CG2 4.36Å; V375-M410 HydrophobicContact CG1-CG 4.19Å; V375-F413 HydrophobicContact CG1-CD2 4.45Å; V375-F413 HydrophobicContact CG2-CB 3.7Å; V375-F413 HydrophobicContact CG2-CD2 4.31Å; V375-F413 HydrophobicContact CG2-CG 4.16Å
376	R	90.8	Very high	84.4	Confident	156 Å²	156	57.2 Å²	57.2	59%	0.589	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140	140.1	178.1	-151.1	-170.8	80.1	159.3	0.5	111.8	F387 L388	R376-F387 CarbonylContact O-C 3.52Å; R376-F387 WeakPolarHBondContact O-CA 3.45Å; R376-L388 HydrophobicContact CB-CB 4.42Å; R376-L388 PolarHBondContact N-O 3.07Å; R376-L388 PolarHBondContact O-N 3.41Å
377	E	90.5	Very high	84.8	Confident	78 Å²	78	56 Å²	56	36%	0.364	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	144.9	165	176.6	146.3	-153.4	0	0	111	K406 M410	E377-K406 VanDerWaalsContact CD-NZ 3.34Å; E377-K406 WeakPolarHBondContact OE1-CE 3.39Å; E377-K406 IonicContact OE1-NZ 2.77Å; E377-K406 PolarHBondContact OE1-NZ 2.8Å; E377-M410 HydrophobicContact CB-SD 4.38Å
378	L	85.1	Confident	85.1	Confident	21 Å²	21	53.1 Å²	53.1	11%	0.11	29%	0.285	C	S	.	.			trans	-117	136.5	167.6	-62.5	177.3	0	0	0	109.1	S386 L388 E397 K406	L378-S386 WeakPolarHBondContact CB-OG 3.14Å; L378-S386 PolarHBondContact N-O 3.22Å; L378-S386 PolarHBondContact O-OG 3.45Å; L378-L388 HydrophobicContact CD1-CB 4.14Å; L378-L388 HydrophobicContact CD2-CB 4.23Å; L378-L388 HydrophobicContact CG-CB 4.16Å; L378-E397 HydrophobicContact CD1-CG 4.09Å; L378-K406 PolarHBondContact O-NZ 2.72Å
379	M	78.8	Confident	85.4	Confident	180 Å²	180	53.1 Å²	53.1	89%	0.887	29%	0.285	S	S	*	.			trans	-109.7	71.7	174.6	-64.6	-178.7	-179.4	0	0	108.2
380	D	75.4	Confident	85.5	Confident	38 Å²	38	52 Å²	52	20%	0.203	28%	0.281	C	S	.	.			trans	-100	125	177.1	-165	-35.7	0	0	0	109.7	E382 F383 R457	D380-E382 VanDerWaalsContact C-N 3.35Å; D380-E382 WeakPolarHBondContact OD1-CB 3.31Å; D380-E382 PolarHBondContact OD1-N 3.43Å; D380-F383 HydrophobicContact CB-CB 4.26Å; D380-F383 CarbonylContact O-C 3.5Å; D380-F383 PolarHBondContact O-N 3.22Å; D380-F383 PolarHBondContact OD1-N 3.25Å; D380-R457 IonicContact OD2-CZ 3.11Å; D380-R457 VanDerWaalsContact OD2-CZ 3.26Å; D380-R457 IonicContact OD2-NH1 2.75Å; D380-R457 PolarHBondContact OD2-NH1 3.16Å; D380-R457 IonicContact OD2-NH2 2.67Å; D380-R457 PolarHBondContact OD2-NH2 3.29Å
381	A	72.3	Confident	85.4	Confident	109 Å²	109	51.9 Å²	51.9	90%	0.901	28%	0.28	S	S	*	.	S	Bend	trans	-76.7	-19.9	-179.9	0	0	0	0	0	113.3
382	E	77.2	Confident	85.3	Confident	106 Å²	106	55.1 Å²	55.1	50%	0.495	29%	0.288	S	S	.	.	S	Bend	trans	-82.4	-26.4	171.5	-166.1	174.7	-145	0	0	110.6	D380	D380-E382 VanDerWaalsContact C-N 3.35Å; D380-E382 WeakPolarHBondContact OD1-CB 3.31Å; D380-E382 PolarHBondContact OD1-N 3.43Å
383	F	82.9	Confident	85.6	Confident	17 Å²	17	56.3 Å²	56.3	8%	0.075	29%	0.286	C	S	.	.	S	Bend	trans	-131.7	80	-176.8	-56	-71.8	0	0	0	112.3	I329 P336 D380 S386	I329-F383 HydrophobicContact CD1-CB 3.69Å; I329-F383 HydrophobicContact CD1-CD1 4.43Å; I329-F383 HydrophobicContact CD1-CD2 4.25Å; I329-F383 HydrophobicContact CD1-CG 3.85Å; I329-F383 HydrophobicContact CG1-CB 4.47Å; I329-F383 HydrophobicContact CG1-CD1 4.35Å; I329-F383 HydrophobicContact CG1-CG 4.22Å; I329-F383 HydrophobicContact CG2-CD2 4.15Å; I329-F383 HydrophobicContact CG2-CE2 4.11Å; I329-F383 HydrophobicContact CG2-CG 4.47Å; I329-F383 HydrophobicContact CG2-CZ 4.4Å; P336-F383 HydrophobicContact CG-CD1 3.76Å; P336-F383 HydrophobicContact CG-CE1 3.56Å; D380-F383 HydrophobicContact CB-CB 4.26Å; D380-F383 CarbonylContact O-C 3.5Å; D380-F383 PolarHBondContact O-N 3.22Å; D380-F383 PolarHBondContact OD1-N 3.25Å; F383-S386 WeakPolarHBondContact O-CB 3.3Å; F383-S386 PolarHBondContact O-OG 2.9Å
384	P	85.8	Confident	85.3	Confident	70 Å²	70	60.1 Å²	60.1	46%	0.455	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	157.1	174.6	27.6	-36	0	0	0	111.5	S386 Q399	P384-S386 PolarHBondContact O-N 2.8Å; P384-Q399 WeakPolarHBondContact O-CG 3.49Å; P384-Q399 PolarHBondContact O-NE2 2.89Å
385	H	91.3	Very high	85.3	Confident	66 Å²	66	55.7 Å²	55.7	31%	0.306	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	28.9	-175.6	-38.8	-59.5	0	0	0	114	A400 Q403 K406	H385-A400 HydrophobicContact CB-CB 4.42Å; H385-A400 PolarHBondContact O-N 2.87Å; H385-A400 VanDerWaalsContact O-N 3.1Å; H385-Q403 PolarHBondContact ND1-OE1 2.79Å; H385-K406 HydrophobicContact CB-CB 4.41Å; H385-K406 HydrophobicContact CB-CD 4.19Å
386	S	92.1	Very high	85.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	152.6	175.4	54	0	0	0	0	113.6	L378 F383 P384 L398 K406	L378-S386 WeakPolarHBondContact CB-OG 3.14Å; L378-S386 PolarHBondContact N-O 3.22Å; L378-S386 PolarHBondContact O-OG 3.45Å; F383-S386 WeakPolarHBondContact O-CB 3.3Å; F383-S386 PolarHBondContact O-OG 2.9Å; P384-S386 PolarHBondContact O-N 2.8Å; S386-L398 CarbonylContact C-O 3.49Å; S386-L398 WeakPolarHBondContact CA-O 3.36Å; S386-L398 WeakPolarHBondContact CB-O 3.21Å; S386-K406 VanDerWaalsContact O-CE 3.3Å; S386-K406 WeakPolarHBondContact O-CE 3.45Å; S386-K406 PolarHBondContact O-NZ 3.15Å
387	F	93.7	Very high	85.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	158.1	176.9	59.8	-83.8	0	0	0	110.6	R376 V389 L398 A400 K406 W409 M410 F413	R376-F387 CarbonylContact O-C 3.52Å; R376-F387 WeakPolarHBondContact O-CA 3.45Å; F387-V389 HydrophobicContact CD2-CG2 3.82Å; F387-V389 HydrophobicContact CE2-CG2 3.76Å; F387-L398 HydrophobicContact CD2-CB 4.27Å; F387-L398 HydrophobicContact CE1-CB 4.17Å; F387-L398 HydrophobicContact CE2-CB 3.83Å; F387-L398 HydrophobicContact CE2-CD1 3.81Å; F387-L398 HydrophobicContact CE2-CG 4.44Å; F387-L398 HydrophobicContact CZ-CB 3.78Å; F387-L398 HydrophobicContact CZ-CD1 4.18Å; F387-L398 PolarHBondContact N-O 2.88Å; F387-L398 PolarHBondContact O-N 3.33Å; F387-A400 HydrophobicContact CE1-CB 4.24Å; F387-K406 HydrophobicContact CD1-CD 4.5Å; F387-K406 HydrophobicContact CD1-CG 4.19Å; F387-W409 HydrophobicContact CZ-CB 4.23Å; F387-W409 HydrophobicContact CZ-CG 4.48Å; F387-M410 HydrophobicContact CB-CG 4.45Å; F387-M410 HydrophobicContact CB-SD 4.1Å; F387-M410 HydrophobicContact CG-CG 4.48Å; F387-F413 AromaticContact CE2-CE2 3.81Å; F387-F413 HydrophobicContact CE2-CE2 3.81Å; F387-F413 HydrophobicContact CZ-CE2 4.49Å
388	L	91.9	Very high	85.4	Confident	19 Å²	19	43.4 Å²	43.4	10%	0.099	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.8	179.1	-167.5	74.9	0	0	0	109	V375 R376 L378 T395 E397	V375-L388 WeakPolarHBondContact CA-O 3.31Å; R376-L388 HydrophobicContact CB-CB 4.42Å; R376-L388 PolarHBondContact N-O 3.07Å; R376-L388 PolarHBondContact O-N 3.41Å; L378-L388 HydrophobicContact CD1-CB 4.14Å; L378-L388 HydrophobicContact CD2-CB 4.23Å; L378-L388 HydrophobicContact CG-CB 4.16Å; L388-T395 HydrophobicContact CD1-CG2 3.59Å; L388-T395 HydrophobicContact CD2-CG2 4.23Å; L388-T395 HydrophobicContact CG-CG2 3.94Å; L388-E397 HydrophobicContact CD1-CG 3.53Å
389	V	92.4	Very high	85.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	116.6	166.7	-178.3	0	0	0	0	108.1	L348 M373 V375 F387 T395 L396 L398 F413	L348-V389 HydrophobicContact CD2-CG1 3.81Å; M373-V389 HydrophobicContact CE-CG1 4.17Å; M373-V389 HydrophobicContact CG-CG1 3.95Å; M373-V389 HydrophobicContact SD-CG1 3.61Å; V375-V389 HydrophobicContact CG2-CG1 4.42Å; V375-V389 HydrophobicContact CG2-CG2 4.36Å; F387-V389 HydrophobicContact CD2-CG2 3.82Å; F387-V389 HydrophobicContact CE2-CG2 3.76Å; V389-T395 CarbonylContact O-C 3.53Å; V389-T395 WeakPolarHBondContact O-CA 3.49Å; V389-L396 PolarHBondContact N-O 3.09Å; V389-L396 PolarHBondContact O-N 2.82Å; V389-L398 HydrophobicContact CB-CD1 4.49Å; V389-L398 HydrophobicContact CG2-CD1 4.04Å; V389-F413 HydrophobicContact CG2-CD2 4.16Å; V389-F413 HydrophobicContact CG2-CE2 3.86Å; V389-F413 HydrophobicContact CG2-CZ 4.23Å
390	S	87.6	Confident	86.5	Confident	17 Å²	17	35.2 Å²	35.2	12%	0.119	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.3	178.9	-177.8	0	0	0	0	110	M373 K374 T395 R451	M373-S390 CarbonylContact C-O 3.35Å; M373-S390 VanDerWaalsContact CA-O 3.26Å; M373-S390 WeakPolarHBondContact CA-O 3.41Å; K374-S390 PolarHBondContact N-O 2.81Å; K374-S390 PolarHBondContact O-N 3.41Å; S390-T395 WeakPolarHBondContact CB-OG1 3.3Å; S390-T395 PolarHBondContact OG-OG1 2.89Å; S390-R451 VanDerWaalsContact C-NH2 3.31Å; S390-R451 PolarHBondContact O-NH2 2.76Å; S390-R451 PolarHBondContact OG-NE 3.18Å; S390-R451 PolarHBondContact OG-NH2 3.5Å; S390-R451 VanDerWaalsContact OG-NH2 3.11Å
391	G	83.4	Confident	87.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.203	C	C	.	.			trans	-131.3	-172	164.8	0	0	0	0	0	110.9	I368 Q393 R394	I368-G391 VanDerWaalsContact CG2-CA 3.5Å; G391-Q393 PolarHBondContact O-N 2.95Å; G391-R394 PolarHBondContact N-O 3.39Å
392	K	77.5	Confident	88.3	Confident	99 Å²	99	36.1 Å²	36.1	43%	0.43	17%	0.172	S	C	.	.	S	Bend	trans	-57.4	-47.1	-173.1	-65	176.6	-179.1	170.9	0	112.2	A371 A452	A371-K392 VanDerWaalsContact O-CE 3.22Å; A371-K392 WeakPolarHBondContact O-CE 3.47Å; A371-K392 PolarHBondContact O-NZ 3.3Å; K392-A452 PolarHBondContact O-N 3.36Å
393	Q	83.2	Confident	89.1	Confident	54 Å²	54	34 Å²	34	25%	0.252	16%	0.162	S	C	.	.	S	Bend	trans	-77.7	-35.7	-174.7	-62.5	81.6	4	0	0	114.6	D369 G391 A452	D369-Q393 VanDerWaalsContact N-OE1 3.07Å; D369-Q393 PolarHBondContact OD2-NE2 2.93Å; G391-Q393 PolarHBondContact O-N 2.95Å; Q393-A452 VanDerWaalsContact C-CB 3.45Å; Q393-A452 WeakPolarHBondContact O-CB 3.17Å
394	R	82.3	Confident	89.6	Confident	88 Å²	88	39.4 Å²	39.4	33%	0.332	19%	0.187	S	C	.	.			trans	-156.4	157.3	-176.9	-72.5	-57.4	170.4	-146.9	-15.2	113.1	T366 I368 G391 N502	T366-R394 HydrophobicContact CG2-CB 3.69Å; T366-R394 HydrophobicContact CG2-CG 3.39Å; I368-R394 HydrophobicContact CD1-CB 4.06Å; I368-R394 HydrophobicContact CG1-CB 4.26Å; G391-R394 PolarHBondContact N-O 3.39Å; R394-N502 PolarHBondContact NH2-OD1 2.79Å
395	T	86.9	Confident	90	Very high	17 Å²	17	38.4 Å²	38.4	10%	0.104	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.2	164.3	-61.4	0	0	0	0	110	L388 V389 S390 A452 Q454	L388-T395 HydrophobicContact CD1-CG2 3.59Å; L388-T395 HydrophobicContact CD2-CG2 4.23Å; L388-T395 HydrophobicContact CG-CG2 3.94Å; V389-T395 CarbonylContact O-C 3.53Å; V389-T395 WeakPolarHBondContact O-CA 3.49Å; S390-T395 WeakPolarHBondContact CB-OG1 3.3Å; S390-T395 PolarHBondContact OG-OG1 2.89Å; T395-A452 PolarHBondContact OG1-O 2.99Å; T395-Q454 HydrophobicContact CG2-CB 4.07Å; T395-Q454 HydrophobicContact CG2-CG 4.2Å
396	L	90.2	Very high	90.2	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.026	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.7	-176.8	-62.7	175.7	0	0	0	110.7	Y350 I368 V389 L398	Y350-L396 HydrophobicContact CD2-CD1 3.77Å; Y350-L396 HydrophobicContact CD2-CD2 4.43Å; Y350-L396 HydrophobicContact CE2-CD2 4.49Å; Y350-L396 HydrophobicContact CG-CD1 3.75Å; Y350-L396 HydrophobicContact CG-CD2 4.44Å; I368-L396 HydrophobicContact CD1-CD1 3.66Å; I368-L396 HydrophobicContact CD1-CG 3.99Å; V389-L396 PolarHBondContact N-O 3.09Å; V389-L396 PolarHBondContact O-N 2.82Å; L396-L398 HydrophobicContact CB-CD1 4.3Å; L396-L398 HydrophobicContact CB-CD2 4.21Å; L396-L398 HydrophobicContact CB-CG 4.02Å
397	E	91.4	Very high	90.3	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.028	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.7	163.3	-72.3	175.8	-150.5	0	0	108.5	I329 F331 L378 L388 Q454 R457	I329-E397 HydrophobicContact CB-CB 3.99Å; I329-E397 HydrophobicContact CD1-CB 4.41Å; I329-E397 PolarHBondContact N-O 3.02Å; F331-E397 WeakPolarHBondContact CE1-OE1 3.44Å; F331-E397 HydrophobicContact CZ-CG 4.27Å; L378-E397 HydrophobicContact CD1-CG 4.09Å; L388-E397 HydrophobicContact CD1-CG 3.53Å; E397-Q454 PolarHBondContact OE1-NE2 2.74Å; E397-R457 IonicContact OE2-CZ 2.74Å; E397-R457 IonicContact OE2-NE 3.6Å; E397-R457 PolarHBondContact OE2-NE 2.88Å; E397-R457 VanDerWaalsContact OE2-NE 3.08Å; E397-R457 IonicContact OE2-NH2 2.81Å; E397-R457 PolarHBondContact OE2-NH2 3.47Å
398	L	93	Very high	90.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	159.1	-172.7	-62.1	176.6	0	0	0	110.7	V326 F327 K328 L341 Y350 S386 F387 V389 L396	V326-L398 HydrophobicContact CG2-CD2 4.08Å; F327-L398 CarbonylContact O-C 3.44Å; F327-L398 WeakPolarHBondContact O-CA 3.48Å; K328-L398 HydrophobicContact CB-CD2 4.04Å; K328-L398 HydrophobicContact CG-CD2 4.04Å; L341-L398 HydrophobicContact CD1-CD1 4.09Å; Y350-L398 HydrophobicContact CE2-CD2 4.45Å; S386-L398 CarbonylContact C-O 3.49Å; S386-L398 WeakPolarHBondContact CA-O 3.36Å; S386-L398 WeakPolarHBondContact CB-O 3.21Å; F387-L398 HydrophobicContact CD2-CB 4.27Å; F387-L398 HydrophobicContact CE1-CB 4.17Å; F387-L398 HydrophobicContact CE2-CB 3.83Å; F387-L398 HydrophobicContact CE2-CD1 3.81Å; F387-L398 HydrophobicContact CE2-CG 4.44Å; F387-L398 HydrophobicContact CZ-CB 3.78Å; F387-L398 HydrophobicContact CZ-CD1 4.18Å; F387-L398 PolarHBondContact N-O 2.88Å; F387-L398 PolarHBondContact O-N 3.33Å; V389-L398 HydrophobicContact CB-CD1 4.49Å; V389-L398 HydrophobicContact CG2-CD1 4.04Å; L396-L398 HydrophobicContact CB-CD1 4.3Å; L396-L398 HydrophobicContact CB-CD2 4.21Å; L396-L398 HydrophobicContact CB-CG 4.02Å
399	Q	93.3	Very high	90.6	Very high	25 Å²	25	40.3 Å²	40.3	12%	0.117	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	129.5	178.9	168.2	175.3	49.3	0	0	109	F327 I329 P384	F327-Q399 HydrophobicContact CB-CB 4.14Å; F327-Q399 HydrophobicContact CB-CG 4.44Å; F327-Q399 PolarHBondContact N-O 3.05Å; F327-Q399 PolarHBondContact O-N 3.42Å; I329-Q399 HydrophobicContact CD1-CB 4.37Å; I329-Q399 HydrophobicContact CG1-CB 4.37Å; P384-Q399 WeakPolarHBondContact O-CG 3.49Å; P384-Q399 PolarHBondContact O-NE2 2.89Å
400	A	93.6	Very high	90.7	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.033	20%	0.2	C	C	.	.			trans	-81.4	166	173.3	0	0	0	0	0	111.4	H385 F387 S402 E405 K406	H385-A400 HydrophobicContact CB-CB 4.42Å; H385-A400 PolarHBondContact O-N 2.87Å; H385-A400 VanDerWaalsContact O-N 3.1Å; F387-A400 HydrophobicContact CE1-CB 4.24Å; A400-S402 VanDerWaalsContact C-N 3.34Å; A400-S402 WeakPolarHBondContact CB-O 3.49Å; A400-E405 HydrophobicContact CB-CB 3.78Å; A400-K406 HydrophobicContact CB-CB 3.76Å
401	R	91.8	Very high	91	Very high	131 Å²	131	47.2 Å²	47.2	49%	0.494	22%	0.222	S	C	.	.	S	Bend	trans	-77.5	-21.6	174.4	-58.2	170.2	160.7	-171.7	-4.4	112.5	F327 E338 E405	F327-R401 HydrophobicContact CD2-CG 4.49Å; F327-R401 HydrophobicContact CE2-CG 3.87Å; E338-R401 IonicContact OE1-CZ 2.89Å; E338-R401 IonicContact OE1-NH2 2.67Å; E338-R401 PolarHBondContact OE1-NH2 2.95Å; R401-E405 VanDerWaalsContact CB-OE2 3.22Å; R401-E405 WeakPolarHBondContact CB-OE2 3.14Å; R401-E405 WeakPolarHBondContact CD-OE1 3.43Å; R401-E405 WeakPolarHBondContact CG-OE2 3.34Å; R401-E405 PolarHBondContact N-OE2 3.05Å
402	S	93.4	Very high	91.6	Very high	34 Å²	34	48.1 Å²	48.1	24%	0.238	23%	0.23	C	C	.	.	S	Bend	trans	-148.5	173.6	175.4	85.4	0	0	0	0	112.4	A400 E404 E405 K406	A400-S402 VanDerWaalsContact C-N 3.34Å; A400-S402 WeakPolarHBondContact CB-O 3.49Å; S402-E404 VanDerWaalsContact C-N 3.33Å; S402-E404 WeakPolarHBondContact CB-OE2 3.45Å; S402-E404 PolarHBondContact OG-N 2.84Å; S402-E404 PolarHBondContact OG-OE2 2.99Å; S402-E405 PolarHBondContact OG-N 3.2Å; S402-K406 PolarHBondContact O-N 3.29Å; S402-K406 VanDerWaalsContact O-N 3.13Å
403	Q	93.7	Very high	92.4	Very high	63 Å²	63	43.4 Å²	43.4	29%	0.294	21%	0.209	S	C	.	.	H	α-helix	trans	-68.3	-34.7	175.9	-173.6	63.5	9.8	0	0	111.9	H385 K406 I407	H385-Q403 PolarHBondContact ND1-OE1 2.79Å; Q403-K406 WeakPolarHBondContact O-CB 3.44Å; Q403-K406 PolarHBondContact O-N 3.48Å; Q403-I407 HydrophobicContact CG-CD1 4.04Å; Q403-I407 WeakPolarHBondContact O-CG1 3.22Å; Q403-I407 PolarHBondContact O-N 2.94Å
404	E	94	Very high	92.9	Very high	129 Å²	129	45.1 Å²	45.1	60%	0.603	22%	0.217	S	C	*	.	H	α-helix	trans	-68.5	-44.1	178.9	-53.4	67.4	-140	0	0	110.2	S402 K406 I407 S408	S402-E404 VanDerWaalsContact C-N 3.33Å; S402-E404 WeakPolarHBondContact CB-OE2 3.45Å; S402-E404 PolarHBondContact OG-N 2.84Å; S402-E404 PolarHBondContact OG-OE2 2.99Å; E404-K406 VanDerWaalsContact C-N 3.32Å; E404-K406 PolarHBondContact O-N 3.19Å; E404-I407 PolarHBondContact O-N 3.32Å; E404-S408 WeakPolarHBondContact O-CB 3.38Å; E404-S408 PolarHBondContact O-N 3.02Å
405	E	94.6	Very high	93.4	Very high	50 Å²	50	43 Å²	43	23%	0.234	22%	0.218	C	C	.	.	H	α-helix	trans	-58.2	-43.5	171.1	-84.7	-169.3	-174.5	0	0	111.4	A400 R401 S402 S408 W409	A400-E405 HydrophobicContact CB-CB 3.78Å; R401-E405 VanDerWaalsContact CB-OE2 3.22Å; R401-E405 WeakPolarHBondContact CB-OE2 3.14Å; R401-E405 WeakPolarHBondContact CD-OE1 3.43Å; R401-E405 WeakPolarHBondContact CG-OE2 3.34Å; R401-E405 PolarHBondContact N-OE2 3.05Å; S402-E405 PolarHBondContact OG-N 3.2Å; E405-S408 PolarHBondContact O-N 3.43Å; E405-W409 WeakPolarHBondContact O-CB 3.33Å; E405-W409 PolarHBondContact O-N 3.33Å
406	K	94.6	Very high	93.6	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-52.3	177.4	164.4	171	170.1	176.4	0	111.7	E377 L378 H385 S386 F387 A400 S402 Q403 E404 S408 W409 M410	E377-K406 VanDerWaalsContact CD-NZ 3.34Å; E377-K406 WeakPolarHBondContact OE1-CE 3.39Å; E377-K406 IonicContact OE1-NZ 2.77Å; E377-K406 PolarHBondContact OE1-NZ 2.8Å; L378-K406 PolarHBondContact O-NZ 2.72Å; H385-K406 HydrophobicContact CB-CB 4.41Å; H385-K406 HydrophobicContact CB-CD 4.19Å; S386-K406 VanDerWaalsContact O-CE 3.3Å; S386-K406 WeakPolarHBondContact O-CE 3.45Å; S386-K406 PolarHBondContact O-NZ 3.15Å; F387-K406 HydrophobicContact CD1-CD 4.5Å; F387-K406 HydrophobicContact CD1-CG 4.19Å; A400-K406 HydrophobicContact CB-CB 3.76Å; S402-K406 PolarHBondContact O-N 3.29Å; S402-K406 VanDerWaalsContact O-N 3.13Å; Q403-K406 WeakPolarHBondContact O-CB 3.44Å; Q403-K406 PolarHBondContact O-N 3.48Å; E404-K406 VanDerWaalsContact C-N 3.32Å; E404-K406 PolarHBondContact O-N 3.19Å; K406-S408 VanDerWaalsContact C-N 3.31Å; K406-S408 PolarHBondContact O-N 2.96Å; K406-W409 PolarHBondContact O-N 2.75Å; K406-M410 HydrophobicContact CG-CE 3.96Å; K406-M410 HydrophobicContact CG-CG 4.5Å; K406-M410 HydrophobicContact CG-SD 4.15Å; K406-M410 WeakPolarHBondContact O-CG 3.43Å; K406-M410 PolarHBondContact O-N 3.25Å
407	I	94.1	Very high	93.5	Very high	72 Å²	72	42.2 Å²	42.2	37%	0.369	21%	0.214	S	C	.	.	H	α-helix	trans	-57.9	-47.9	179.2	-69.2	165.5	0	0	0	109.8	Q403 E404 W409 M410 Q411	Q403-I407 HydrophobicContact CG-CD1 4.04Å; Q403-I407 WeakPolarHBondContact O-CG1 3.22Å; Q403-I407 PolarHBondContact O-N 2.94Å; E404-I407 PolarHBondContact O-N 3.32Å; I407-W409 VanDerWaalsContact C-N 3.35Å; I407-W409 PolarHBondContact O-N 2.73Å; I407-M410 PolarHBondContact O-N 3.49Å; I407-Q411 HydrophobicContact CG2-CG 4.37Å; I407-Q411 WeakPolarHBondContact O-CB 3.37Å; I407-Q411 VanDerWaalsContact O-CG 3.3Å; I407-Q411 WeakPolarHBondContact O-CG 3.45Å; I407-Q411 PolarHBondContact O-N 3.24Å
408	S	96	Very high	93.3	Very high	44 Å²	44	44.5 Å²	44.5	31%	0.308	23%	0.226	S	C	.	.	H	α-helix	trans	-69	-29.2	-177.5	-164.8	0	0	0	0	113.1	R322 E404 E405 K406 A412	R322-S408 PolarHBondContact NH1-O 3.06Å; R322-S408 PolarHBondContact NH1-OG 2.77Å; R322-S408 PolarHBondContact NH2-OG 3.24Å; E404-S408 WeakPolarHBondContact O-CB 3.38Å; E404-S408 PolarHBondContact O-N 3.02Å; E405-S408 PolarHBondContact O-N 3.43Å; K406-S408 VanDerWaalsContact C-N 3.31Å; K406-S408 PolarHBondContact O-N 2.96Å; S408-A412 WeakPolarHBondContact O-CB 3.5Å; S408-A412 PolarHBondContact O-N 3.18Å
409	W	96.3	Very high	92.8	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-70.1	-48.7	167.8	-89.5	116.5	0	0	0	112.3	R322 V326 L341 L343 F387 E405 K406 I407 Q411 A412 F413	R322-W409 HydrophobicContact CB-CH2 4.28Å; R322-W409 HydrophobicContact CB-CZ3 4.01Å; R322-W409 VanDerWaalsContact CD-CE3 3.44Å; R322-W409 HydrophobicContact CG-CE3 4.16Å; R322-W409 HydrophobicContact CG-CH2 3.72Å; R322-W409 HydrophobicContact CG-CZ2 4.2Å; R322-W409 HydrophobicContact CG-CZ3 3.71Å; R322-W409 VanDerWaalsContact NE-CD2 3.27Å; V326-W409 HydrophobicContact CG1-CZ2 4.44Å; L341-W409 HydrophobicContact CB-CH2 3.55Å; L341-W409 HydrophobicContact CB-CZ2 4.04Å; L341-W409 HydrophobicContact CB-CZ3 4.1Å; L341-W409 HydrophobicContact CD1-CD2 4.48Å; L341-W409 HydrophobicContact CD1-CE3 4.27Å; L341-W409 HydrophobicContact CD1-CH2 4.11Å; L341-W409 HydrophobicContact CD1-CZ2 4.28Å; L341-W409 HydrophobicContact CD1-CZ3 4.09Å; L341-W409 HydrophobicContact CG-CH2 4.4Å; L343-W409 HydrophobicContact CB-CZ3 4.29Å; F387-W409 HydrophobicContact CZ-CB 4.23Å; F387-W409 HydrophobicContact CZ-CG 4.48Å; E405-W409 WeakPolarHBondContact O-CB 3.33Å; E405-W409 PolarHBondContact O-N 3.33Å; K406-W409 PolarHBondContact O-N 2.75Å; I407-W409 VanDerWaalsContact C-N 3.35Å; I407-W409 PolarHBondContact O-N 2.73Å; W409-Q411 VanDerWaalsContact C-N 3.33Å; W409-Q411 PolarHBondContact O-N 3.35Å; W409-A412 PolarHBondContact O-N 3.11Å; W409-F413 HydrophobicContact CB-CE2 4.06Å; W409-F413 HydrophobicContact CD2-CE2 4.36Å; W409-F413 HydrophobicContact CD2-CZ 4.31Å; W409-F413 HydrophobicContact CE3-CE1 4.08Å; W409-F413 AromaticContact CE3-CE2 3.74Å; W409-F413 HydrophobicContact CE3-CE2 3.74Å; W409-F413 AromaticContact CE3-CZ 3.4Å; W409-F413 HydrophobicContact CE3-CZ 3.4Å; W409-F413 VanDerWaalsContact CE3-CZ 3.4Å; W409-F413 HydrophobicContact CZ3-CE1 4.21Å; W409-F413 AromaticContact CZ3-CZ 3.86Å; W409-F413 HydrophobicContact CZ3-CZ 3.86Å; W409-F413 WeakPolarHBondContact O-CD2 3.29Å; W409-F413 PolarHBondContact O-N 3.45Å
410	M	93.6	Very high	92	Very high	39 Å²	39	48.4 Å²	48.4	19%	0.192	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-42	179.9	-67.3	-171.4	-47	0	0	111.7	V375 E377 F387 K406 I407 F413 Q414	V375-M410 HydrophobicContact CG1-CG 4.19Å; E377-M410 HydrophobicContact CB-SD 4.38Å; F387-M410 HydrophobicContact CB-CG 4.45Å; F387-M410 HydrophobicContact CB-SD 4.1Å; F387-M410 HydrophobicContact CG-CG 4.48Å; K406-M410 HydrophobicContact CG-CE 3.96Å; K406-M410 HydrophobicContact CG-CG 4.5Å; K406-M410 HydrophobicContact CG-SD 4.15Å; K406-M410 WeakPolarHBondContact O-CG 3.43Å; K406-M410 PolarHBondContact O-N 3.25Å; I407-M410 PolarHBondContact O-N 3.49Å; M410-F413 PolarHBondContact O-N 3.25Å; M410-Q414 PolarHBondContact O-N 3.22Å
411	Q	94.6	Very high	91.3	Very high	123 Å²	123	52.4 Å²	52.4	58%	0.575	26%	0.262	S	S	*	.	H	α-helix	trans	-60.1	-44.1	173.3	-74.6	171.7	-24.9	0	0	112.4	I407 W409 Q414 A415	I407-Q411 HydrophobicContact CG2-CG 4.37Å; I407-Q411 WeakPolarHBondContact O-CB 3.37Å; I407-Q411 VanDerWaalsContact O-CG 3.3Å; I407-Q411 WeakPolarHBondContact O-CG 3.45Å; I407-Q411 PolarHBondContact O-N 3.24Å; W409-Q411 VanDerWaalsContact C-N 3.33Å; W409-Q411 PolarHBondContact O-N 3.35Å; Q411-Q414 PolarHBondContact O-N 3.33Å; Q411-A415 WeakPolarHBondContact O-CB 3.38Å; Q411-A415 PolarHBondContact O-N 3.48Å
412	A	95.5	Very high	90.5	Very high	19 Å²	19	51.9 Å²	51.9	16%	0.157	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-39.9	179.1	0	0	0	0	0	112.5	R322 L343 S408 W409 A416	R322-A412 HydrophobicContact CB-CB 4.2Å; L343-A412 HydrophobicContact CD2-CB 4Å; L343-A412 WeakPolarHBondContact CD2-O 3.22Å; S408-A412 WeakPolarHBondContact O-CB 3.5Å; S408-A412 PolarHBondContact O-N 3.18Å; W409-A412 PolarHBondContact O-N 3.11Å; A412-A416 WeakPolarHBondContact O-CB 3.19Å; A412-A416 PolarHBondContact O-N 3.1Å; A412-A416 VanDerWaalsContact O-N 3.16Å
413	F	95.1	Very high	89	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-45.3	173.8	-63.3	-56.4	0	0	0	112.2	L341 L343 L348 M373 V375 F387 V389 W409 M410 A416 V417	L341-F413 HydrophobicContact CD1-CZ 3.93Å; L343-F413 HydrophobicContact CB-CE1 4.39Å; L343-F413 HydrophobicContact CD1-CD1 3.8Å; L343-F413 HydrophobicContact CD1-CE1 4.01Å; L343-F413 HydrophobicContact CD2-CD1 3.61Å; L343-F413 HydrophobicContact CD2-CE1 3.94Å; L343-F413 HydrophobicContact CD2-CG 4.41Å; L343-F413 HydrophobicContact CG-CD1 4.25Å; L343-F413 HydrophobicContact CG-CE1 4.34Å; L348-F413 HydrophobicContact CD1-CE1 3.87Å; L348-F413 HydrophobicContact CD1-CZ 4.44Å; L348-F413 HydrophobicContact CD2-CD1 4.45Å; L348-F413 HydrophobicContact CD2-CE1 3.65Å; L348-F413 HydrophobicContact CD2-CZ 4.13Å; L348-F413 HydrophobicContact CG-CE1 4.29Å; M373-F413 HydrophobicContact SD-CD1 4.24Å; V375-F413 HydrophobicContact CG1-CD2 4.45Å; V375-F413 HydrophobicContact CG2-CB 3.7Å; V375-F413 HydrophobicContact CG2-CD2 4.31Å; V375-F413 HydrophobicContact CG2-CG 4.16Å; F387-F413 AromaticContact CE2-CE2 3.81Å; F387-F413 HydrophobicContact CE2-CE2 3.81Å; F387-F413 HydrophobicContact CZ-CE2 4.49Å; V389-F413 HydrophobicContact CG2-CD2 4.16Å; V389-F413 HydrophobicContact CG2-CE2 3.86Å; V389-F413 HydrophobicContact CG2-CZ 4.23Å; W409-F413 HydrophobicContact CB-CE2 4.06Å; W409-F413 HydrophobicContact CD2-CE2 4.36Å; W409-F413 HydrophobicContact CD2-CZ 4.31Å; W409-F413 HydrophobicContact CE3-CE1 4.08Å; W409-F413 AromaticContact CE3-CE2 3.74Å; W409-F413 HydrophobicContact CE3-CE2 3.74Å; W409-F413 AromaticContact CE3-CZ 3.4Å; W409-F413 HydrophobicContact CE3-CZ 3.4Å; W409-F413 VanDerWaalsContact CE3-CZ 3.4Å; W409-F413 HydrophobicContact CZ3-CE1 4.21Å; W409-F413 AromaticContact CZ3-CZ 3.86Å; W409-F413 HydrophobicContact CZ3-CZ 3.86Å; W409-F413 WeakPolarHBondContact O-CD2 3.29Å; W409-F413 PolarHBondContact O-N 3.45Å; M410-F413 PolarHBondContact O-N 3.25Å; F413-A416 WeakPolarHBondContact O-CB 3.45Å; F413-A416 PolarHBondContact O-N 3.5Å; F413-V417 WeakPolarHBondContact O-CG2 3.36Å; F413-V417 PolarHBondContact O-N 2.7Å
414	Q	92.9	Very high	87.5	Confident	91 Å²	91	56.4 Å²	56.4	43%	0.425	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-47.3	179.9	-168.6	61.3	53.8	0	0	110.8	M410 Q411 A416 V417 D418	M410-Q414 PolarHBondContact O-N 3.22Å; Q411-Q414 PolarHBondContact O-N 3.33Å; Q414-A416 PolarHBondContact O-N 2.67Å; Q414-V417 PolarHBondContact O-N 3.17Å; Q414-D418 PolarHBondContact NE2-OD1 3.43Å; Q414-D418 WeakPolarHBondContact O-CB 3.44Å; Q414-D418 VanDerWaalsContact O-CG 3.24Å; Q414-D418 PolarHBondContact O-N 2.95Å
415	A	92.4	Very high	86	Confident	42 Å²	42	55.9 Å²	55.9	35%	0.347	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-31.6	176	0	0	0	0	0	113.3	Q411 Q419	Q411-A415 WeakPolarHBondContact O-CB 3.38Å; Q411-A415 PolarHBondContact O-N 3.48Å; A415-Q419 WeakPolarHBondContact O-CB 3.36Å; A415-Q419 WeakPolarHBondContact O-CG 3.39Å; A415-Q419 PolarHBondContact O-N 2.9Å; A415-Q419 PolarHBondContact O-NE2 3.04Å
416	A	90.9	Very high	84.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-71.9	-40.1	174.3	0	0	0	0	0	112.4	L321 L343 V370 A412 F413 Q414 I420	L321-A416 HydrophobicContact CD1-CB 3.47Å; L321-A416 VanDerWaalsContact CD1-CB 3.47Å; L343-A416 HydrophobicContact CD1-CB 4.34Å; L343-A416 HydrophobicContact CD2-CB 4.33Å; V370-A416 HydrophobicContact CG1-CB 3.8Å; A412-A416 WeakPolarHBondContact O-CB 3.19Å; A412-A416 PolarHBondContact O-N 3.1Å; A412-A416 VanDerWaalsContact O-N 3.16Å; F413-A416 WeakPolarHBondContact O-CB 3.45Å; F413-A416 PolarHBondContact O-N 3.5Å; Q414-A416 PolarHBondContact O-N 2.67Å; A416-I420 PolarHBondContact O-N 3.3Å
417	V	89.6	Confident	81.6	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-52.8	174.4	173.6	0	0	0	0	110.1	V370 M373 F413 Q414 Q419 I420 E421	V370-V417 HydrophobicContact CG1-CB 4.43Å; V370-V417 HydrophobicContact CG1-CG2 3.75Å; M373-V417 HydrophobicContact CB-CG2 4.04Å; F413-V417 WeakPolarHBondContact O-CG2 3.36Å; F413-V417 PolarHBondContact O-N 2.7Å; Q414-V417 PolarHBondContact O-N 3.17Å; V417-Q419 PolarHBondContact O-N 3.43Å; V417-I420 PolarHBondContact O-N 2.93Å; V417-E421 HydrophobicContact CG1-CG 4.31Å; V417-E421 WeakPolarHBondContact CG1-OE1 3.38Å; V417-E421 PolarHBondContact O-N 2.91Å
418	D	87.3	Confident	79.3	Confident	53 Å²	53	69.4 Å²	69.4	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-52.9	-38.8	177.9	-68.3	13	0	0	0	112.7	Q414 K422	Q414-D418 PolarHBondContact NE2-OD1 3.43Å; Q414-D418 WeakPolarHBondContact O-CB 3.44Å; Q414-D418 VanDerWaalsContact O-CG 3.24Å; Q414-D418 PolarHBondContact O-N 2.95Å; D418-K422 WeakPolarHBondContact O-CB 3.09Å; D418-K422 WeakPolarHBondContact O-CD 3.35Å; D418-K422 VanDerWaalsContact O-CG 3.27Å; D418-K422 WeakPolarHBondContact O-CG 3.24Å; D418-K422 PolarHBondContact O-N 3.08Å; D418-K422 IonicContact OD2-NZ 3.59Å
419	Q	82.3	Confident	77.1	Confident	101 Å²	101	71.1 Å²	71.1	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-69.1	-41.8	178.3	-79.8	173.2	36	0	0	112.3	A415 V417 E421 R423	A415-Q419 WeakPolarHBondContact O-CB 3.36Å; A415-Q419 WeakPolarHBondContact O-CG 3.39Å; A415-Q419 PolarHBondContact O-N 2.9Å; A415-Q419 PolarHBondContact O-NE2 3.04Å; V417-Q419 PolarHBondContact O-N 3.43Å; Q419-E421 VanDerWaalsContact C-N 3.35Å; Q419-R423 VanDerWaalsContact O-CB 3.27Å; Q419-R423 WeakPolarHBondContact O-CB 3.44Å; Q419-R423 PolarHBondContact O-N 3.01Å; Q419-R423 VanDerWaalsContact O-N 3.08Å
420	I	76.4	Confident	74.6	Confident	6 Å²	6	75.2 Å²	75.2	3%	0.031	39%	0.391	C	S	.	.	H	α-helix	trans	-65.5	-42	174.2	-69.3	-177.4	0	0	0	110.3	N345 V370 A371 A416 V417 R423 N424	N345-I420 WeakPolarHBondContact O-CD1 3.39Å; N345-I420 WeakPolarHBondContact O-CG1 3.22Å; V370-I420 HydrophobicContact CB-CD1 3.59Å; V370-I420 HydrophobicContact CG1-CD1 3.65Å; V370-I420 HydrophobicContact CG1-CG1 4.47Å; A371-I420 HydrophobicContact CB-CD1 4.44Å; A371-I420 HydrophobicContact CB-CG2 4.08Å; A416-I420 PolarHBondContact O-N 3.3Å; V417-I420 PolarHBondContact O-N 2.93Å; I420-R423 PolarHBondContact O-N 2.93Å; I420-N424 WeakPolarHBondContact CG2-ND2 3.46Å; I420-N424 VanDerWaalsContact O-CB 3.32Å; I420-N424 WeakPolarHBondContact O-CB 3.37Å; I420-N424 PolarHBondContact O-N 3.03Å; I420-N424 PolarHBondContact O-ND2 3.23Å; I420-N424 PolarHBondContact O-OD1 3.48Å
421	E	78.2	Confident	71.9	Confident	88 Å²	88	77 Å²	77	41%	0.411	41%	0.412	S	S	.	.	H	α-helix	trans	-66.7	-49.8	-177.7	-71.6	176.2	169.7	0	0	110.9	V417 Q419 R423 N424 E425	V417-E421 HydrophobicContact CG1-CG 4.31Å; V417-E421 WeakPolarHBondContact CG1-OE1 3.38Å; V417-E421 PolarHBondContact O-N 2.91Å; Q419-E421 VanDerWaalsContact C-N 3.35Å; E421-R423 VanDerWaalsContact C-N 3.29Å; E421-R423 PolarHBondContact O-N 2.78Å; E421-N424 CarbonylContact O-C 3.54Å; E421-N424 PolarHBondContact O-N 3.48Å; E421-E425 WeakPolarHBondContact O-CB 3.36Å; E421-E425 WeakPolarHBondContact O-CG 3.43Å; E421-E425 PolarHBondContact O-N 2.99Å
422	K	74.8	Confident	69.2	Low	121 Å²	121	80.1 Å²	80.1	53%	0.526	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-37.6	173.8	-72	162.7	-174.8	157	0	113.3	D418 E425 T426	D418-K422 WeakPolarHBondContact O-CB 3.09Å; D418-K422 WeakPolarHBondContact O-CD 3.35Å; D418-K422 VanDerWaalsContact O-CG 3.27Å; D418-K422 WeakPolarHBondContact O-CG 3.24Å; D418-K422 PolarHBondContact O-N 3.08Å; D418-K422 IonicContact OD2-NZ 3.59Å; K422-E425 WeakPolarHBondContact CA-OE2 3.27Å; K422-T426 WeakPolarHBondContact O-CB 3.47Å; K422-T426 PolarHBondContact O-N 2.84Å; K422-T426 PolarHBondContact O-OG1 2.8Å
423	R	63.1	Low	66.2	Low	128 Å²	128	82.5 Å²	82.5	48%	0.483	45%	0.453	S	S	.	.	H	α-helix	trans	-64.4	-47.3	173.3	-173	-174.3	68.4	175	0.6	110.7	Q419 I420 E421 E425 T426 F427	Q419-R423 VanDerWaalsContact O-CB 3.27Å; Q419-R423 WeakPolarHBondContact O-CB 3.44Å; Q419-R423 PolarHBondContact O-N 3.01Å; Q419-R423 VanDerWaalsContact O-N 3.08Å; I420-R423 PolarHBondContact O-N 2.93Å; E421-R423 VanDerWaalsContact C-N 3.29Å; E421-R423 PolarHBondContact O-N 2.78Å; R423-E425 PolarHBondContact O-N 3.26Å; R423-T426 WeakPolarHBondContact O-CB 3.44Å; R423-T426 PolarHBondContact O-N 2.82Å; R423-F427 HydrophobicContact CG-CD2 4.1Å; R423-F427 HydrophobicContact CG-CE2 3.96Å; R423-F427 VanDerWaalsContact O-CD2 3.29Å; R423-F427 WeakPolarHBondContact O-CD2 3.27Å; R423-F427 PolarHBondContact O-N 2.8Å
424	N	61.8	Low	63.6	Low	64 Å²	64	88.9 Å²	88.9	34%	0.342	49%	0.494	S	S	.	.	H	α-helix	trans	-67.8	-33.5	-179.8	-64.9	-9.6	0	0	0	112.3	I420 E421 F427 K428	I420-N424 WeakPolarHBondContact CG2-ND2 3.46Å; I420-N424 VanDerWaalsContact O-CB 3.32Å; I420-N424 WeakPolarHBondContact O-CB 3.37Å; I420-N424 PolarHBondContact O-N 3.03Å; I420-N424 PolarHBondContact O-ND2 3.23Å; I420-N424 PolarHBondContact O-OD1 3.48Å; E421-N424 CarbonylContact O-C 3.54Å; E421-N424 PolarHBondContact O-N 3.48Å; N424-F427 PolarHBondContact O-N 3.15Å; N424-K428 WeakPolarHBondContact O-CB 2.93Å; N424-K428 WeakPolarHBondContact O-CG 3.11Å; N424-K428 PolarHBondContact O-N 2.93Å
425	E	61.1	Low	60.7	Low	118 Å²	118	94 Å²	94	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-62.5	-43.5	169.2	-73.4	170	167.1	0	0	111.1	E421 K422 R423 F427 K428 A429	E421-E425 WeakPolarHBondContact O-CB 3.36Å; E421-E425 WeakPolarHBondContact O-CG 3.43Å; E421-E425 PolarHBondContact O-N 2.99Å; K422-E425 WeakPolarHBondContact CA-OE2 3.27Å; R423-E425 PolarHBondContact O-N 3.26Å; E425-F427 VanDerWaalsContact C-N 3.31Å; E425-F427 PolarHBondContact O-N 3.2Å; E425-K428 CarbonylContact O-C 3.57Å; E425-K428 PolarHBondContact O-N 2.93Å; E425-A429 WeakPolarHBondContact O-CB 3.4Å; E425-A429 PolarHBondContact O-N 3.07Å
426	T	55.5	Low	57.8	Low	103 Å²	103	95.4 Å²	95.4	63%	0.632	54%	0.536	S	S	*	.	H	α-helix	trans	-61.1	-39.7	174.6	-52.5	0	0	0	0	111.5	K422 R423	K422-T426 WeakPolarHBondContact O-CB 3.47Å; K422-T426 PolarHBondContact O-N 2.84Å; K422-T426 PolarHBondContact O-OG1 2.8Å; R423-T426 WeakPolarHBondContact O-CB 3.44Å; R423-T426 PolarHBondContact O-N 2.82Å
427	F	41.8	Very low	55.3	Low	148 Å²	148	103.6 Å²	103.6	65%	0.649	58%	0.58	S	S	*	*	H	α-helix	trans	-67.2	-41.8	171.7	-84.2	-76.9	0	0	0	113	R423 N424 E425 A429 A430	R423-F427 HydrophobicContact CG-CD2 4.1Å; R423-F427 HydrophobicContact CG-CE2 3.96Å; R423-F427 VanDerWaalsContact O-CD2 3.29Å; R423-F427 WeakPolarHBondContact O-CD2 3.27Å; R423-F427 PolarHBondContact O-N 2.8Å; N424-F427 PolarHBondContact O-N 3.15Å; E425-F427 VanDerWaalsContact C-N 3.31Å; E425-F427 PolarHBondContact O-N 3.2Å; F427-A429 VanDerWaalsContact C-N 3.35Å; F427-A429 PolarHBondContact O-N 3.23Å; F427-A430 WeakPolarHBondContact O-CB 3.24Å; F427-A430 PolarHBondContact O-N 3.31Å
428	K	46.5	Very low	52.5	Low	158 Å²	158	108.9 Å²	108.9	69%	0.687	61%	0.613	S	S	*	*	H	α-helix	trans	-63.5	-37.6	174.9	-78.1	-180	173.9	-173.1	0	112.2	N424 E425 A430 A431	N424-K428 WeakPolarHBondContact O-CB 2.93Å; N424-K428 WeakPolarHBondContact O-CG 3.11Å; N424-K428 PolarHBondContact O-N 2.93Å; E425-K428 CarbonylContact O-C 3.57Å; E425-K428 PolarHBondContact O-N 2.93Å; K428-A430 PolarHBondContact O-N 3.23Å; K428-A431 CarbonylContact O-C 3.54Å; K428-A431 VanDerWaalsContact O-C 3.22Å; K428-A431 WeakPolarHBondContact O-CA 3.38Å; K428-A431 PolarHBondContact O-N 3.07Å
429	A	50	Low	49.9	Very low	80 Å²	80	113.6 Å²	113.6	66%	0.661	63%	0.633	S	S	*	*	H	α-helix	trans	-63.1	-25	177.4	0	0	0	0	0	112.9	E425 F427 A431	E425-A429 WeakPolarHBondContact O-CB 3.4Å; E425-A429 PolarHBondContact O-N 3.07Å; F427-A429 VanDerWaalsContact C-N 3.35Å; F427-A429 PolarHBondContact O-N 3.23Å; A429-A431 VanDerWaalsContact C-N 3.33Å
430	A	42.6	Very low	47.7	Very low	90 Å²	90	115.7 Å²	115.7	74%	0.744	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-11.8	171.3	0	0	0	0	0	113.9	F427 K428	F427-A430 WeakPolarHBondContact O-CB 3.24Å; F427-A430 PolarHBondContact O-N 3.31Å; K428-A430 PolarHBondContact O-N 3.23Å
431	A	38.3	Very low	45.6	Very low	77 Å²	77	124.5 Å²	124.5	64%	0.636	68%	0.684	S	S	*	*	S	Bend	trans	-125.3	79.6	-179.4	0	0	0	0	0	110.6	K428 A429	K428-A431 CarbonylContact O-C 3.54Å; K428-A431 VanDerWaalsContact O-C 3.22Å; K428-A431 WeakPolarHBondContact O-CA 3.38Å; K428-A431 PolarHBondContact O-N 3.07Å; A429-A431 VanDerWaalsContact C-N 3.33Å
432	Q	37	Very low	43.3	Very low	189 Å²	189	127.6 Å²	127.6	88%	0.883	70%	0.698	S	S	*	*			trans	-51.6	139.1	-165.1	-59.7	178.3	-5.6	0	0	116.5
433	G	32.3	Very low	41.6	Very low	68 Å²	68	125.5 Å²	125.5	70%	0.701	69%	0.692	S	S	*	*			trans	163.1	118.3	164.3	0	0	0	0	0	113.4
434	P	40.3	Very low	40.5	Very low	134 Å²	134	127.9 Å²	127.9	87%	0.87	71%	0.709	S	S	*	*			trans	-103.6	89.2	-176.1	37	-31.1	0	0	0	114.2
435	E	32.5	Very low	39.7	Very low	200 Å²	200	128.5 Å²	128.5	94%	0.935	72%	0.719	S	S	*	*			trans	-142.3	141	162.9	-62.6	-178.4	165.7	0	0	107.2
436	G	30.7	Very low	39.2	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	72%	0.721	S	S	*	*			cis	165.8	100.9	-3.1	0	0	0	0	0	108.6	T438	G436-T438 PolarHBondContact O-N 2.89Å
437	D	39.7	Very low	39.5	Very low	173 Å²	173	128 Å²	128	93%	0.925	71%	0.709	S	S	*	*			trans	-65.2	128.1	-168.3	-78.7	-43.7	0	0	0	113.8
438	T	29.8	Very low	41	Very low	118 Å²	118	122.4 Å²	122.4	72%	0.724	69%	0.686	S	S	*	*			trans	-151.2	124.3	163.2	-39.3	0	0	0	0	113.1	G436	G436-T438 PolarHBondContact O-N 2.89Å
439	Q	33.8	Very low	42	Very low	152 Å²	152	115 Å²	115	71%	0.71	66%	0.655	S	S	*	*			trans	56.1	109	155.3	-72.5	166	-23.4	0	0	121.6	Q441	Q439-Q441 VanDerWaalsContact C-N 3.34Å; Q439-Q441 PolarHBondContact O-N 3.42Å
440	E	34.8	Very low	43.1	Very low	144 Å²	144	115.3 Å²	115.3	67%	0.673	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-0.8	173.1	-78.9	-156.9	101.7	0	0	116.4	K374	K374-E440 IonicContact NZ-OE1 3.6Å; K374-E440 PolarHBondContact NZ-OE1 3.13Å
441	Q	32.8	Very low	44.5	Very low	191 Å²	191	112.1 Å²	112.1	89%	0.893	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-17.8	-165.8	-89.1	-177.7	-46.9	0	0	117.3	Q439	Q439-Q441 VanDerWaalsContact C-N 3.34Å; Q439-Q441 PolarHBondContact O-N 3.42Å
442	E	30.4	Very low	46.2	Very low	154 Å²	154	108.6 Å²	108.6	72%	0.72	58%	0.584	S	S	*	*	S	Bend	trans	-91	-20.5	177.1	-60.1	-162.4	123.1	0	0	113.4	Q444 S445	E442-Q444 PolarHBondContact O-N 3.28Å; E442-S445 PolarHBondContact O-N 3.46Å; E442-S445 VanDerWaalsContact O-N 3.16Å
443	L	38	Very low	48.1	Very low	76 Å²	76	101 Å²	101	40%	0.398	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	-20.9	-168.9	-63.3	172.4	0	0	0	116.1	S445 E446 E447	L443-S445 PolarHBondContact O-N 2.93Å; L443-E446 PolarHBondContact O-N 3.22Å; L443-E447 PolarHBondContact O-N 2.86Å; L443-E447 VanDerWaalsContact O-N 3.11Å
444	Q	41	Very low	49.9	Very low	178 Å²	178	102 Å²	102	83%	0.832	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.5	178.6	-70.4	-160.4	16.2	0	0	113.6	E442	E442-Q444 PolarHBondContact O-N 3.28Å
445	S	45.6	Very low	51.5	Low	78 Å²	78	98.5 Å²	98.5	55%	0.545	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-36.8	172.7	-60.5	0	0	0	0	111.5	E442 L443 L448 F516	E442-S445 PolarHBondContact O-N 3.46Å; E442-S445 VanDerWaalsContact O-N 3.16Å; L443-S445 PolarHBondContact O-N 2.93Å; S445-L448 WeakPolarHBondContact O-CB 3.41Å; S445-F516 WeakPolarHBondContact O-CZ 3.17Å
446	E	50	Low	53.3	Low	130 Å²	130	90 Å²	90	61%	0.607	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-32.4	-172	-55.7	-167.6	126.9	0	0	113.2	L443 L448 L450	L443-E446 PolarHBondContact O-N 3.22Å; E446-L448 PolarHBondContact O-N 3.2Å; E446-L450 WeakPolarHBondContact O-CD1 3.48Å
447	E	61.3	Low	54.8	Low	80 Å²	80	88 Å²	88	37%	0.374	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-2.8	173.9	-78.9	-159.3	135.5	0	0	114	L443 G449 L450 R451	L443-E447 PolarHBondContact O-N 2.86Å; L443-E447 VanDerWaalsContact O-N 3.11Å; E447-G449 PolarHBondContact O-N 2.89Å; E447-L450 WeakPolarHBondContact O-CA 3.33Å; E447-L450 WeakPolarHBondContact O-CB 3.48Å; E447-L450 PolarHBondContact O-N 3.23Å; E447-R451 HydrophobicContact CB-CB 4.29Å; E447-R451 PolarHBondContact O-N 2.92Å; E447-R451 VanDerWaalsContact O-N 3.1Å; E447-R451 WeakPolarHBondContact OE1-CD 3.49Å; E447-R451 IonicContact OE1-NH1 3.77Å; E447-R451 PolarHBondContact OE1-NH1 3.42Å; E447-R451 WeakPolarHBondContact OE2-CD 3.47Å; E447-R451 IonicContact OE2-NE 2.73Å
448	L	74	Confident	56	Low	31 Å²	31	81.5 Å²	81.5	16%	0.162	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-60	114.7	-174.2	-167.7	75.4	0	0	0	111.2	S445 E446 L450 A483 C484 C513 F516 L517	S445-L448 WeakPolarHBondContact O-CB 3.41Å; E446-L448 PolarHBondContact O-N 3.2Å; L448-L450 PolarHBondContact O-N 3.45Å; L448-A483 HydrophobicContact CD1-CB 4.02Å; L448-A483 WeakPolarHBondContact CD1-O 3.26Å; L448-A483 HydrophobicContact CG-CB 4.25Å; L448-C484 HydrophobicContact CD1-CB 4.07Å; L448-C513 HydrophobicContact CD2-CB 4.23Å; L448-F516 HydrophobicContact CB-CD1 4.3Å; L448-F516 HydrophobicContact CB-CE1 4.03Å; L448-F516 HydrophobicContact CD2-CB 4.15Å; L448-F516 HydrophobicContact CD2-CD1 3.55Å; L448-F516 HydrophobicContact CD2-CE1 4.1Å; L448-F516 HydrophobicContact CD2-CG 3.92Å; L448-F516 HydrophobicContact CG-CD1 4.46Å; L448-L517 HydrophobicContact CD2-CG 4.36Å; L448-L517 HydrophobicContact CG-CD2 4.45Å; L448-L517 VanDerWaalsContact O-CD2 3.24Å; L448-L517 WeakPolarHBondContact O-CD2 3.45Å
449	G	66.8	Low	57.5	Low	3 Å²	3	82.8 Å²	82.8	3%	0.031	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-12.4	-176.2	0	0	0	0	0	115.2	E447 L499 K500 Y501	E447-G449 PolarHBondContact O-N 2.89Å; G449-L499 CarbonylContact O-C 3.58Å; G449-K500 PolarHBondContact O-N 2.85Å; G449-Y501 WeakPolarHBondContact O-CD1 3.39Å; G449-Y501 PolarHBondContact O-N 2.8Å
450	L	72.9	Confident	58.6	Low	85 Å²	85	77.9 Å²	77.9	45%	0.445	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-28.2	165	-53	-171.8	0	0	0	111.8	E446 E447 L448 K500 Y501	E446-L450 WeakPolarHBondContact O-CD1 3.48Å; E447-L450 WeakPolarHBondContact O-CA 3.33Å; E447-L450 WeakPolarHBondContact O-CB 3.48Å; E447-L450 PolarHBondContact O-N 3.23Å; L448-L450 PolarHBondContact O-N 3.45Å; L450-K500 HydrophobicContact CD2-CB 4.29Å; L450-K500 HydrophobicContact CD2-CD 3.45Å; L450-K500 VanDerWaalsContact CD2-CD 3.45Å; L450-K500 HydrophobicContact CD2-CG 4.44Å; L450-Y501 WeakPolarHBondContact O-CB 3.49Å
451	R	72.8	Confident	59.9	Low	24 Å²	24	71.1 Å²	71.1	9%	0.091	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-130.3	150.7	-177.9	-176.2	175.4	-167.1	120.8	1.5	112.2	G372 S390 E447 Y501	G372-R451 PolarHBondContact O-NH1 2.84Å; G372-R451 VanDerWaalsContact O-NH1 3.08Å; G372-R451 PolarHBondContact O-NH2 3.18Å; S390-R451 VanDerWaalsContact C-NH2 3.31Å; S390-R451 PolarHBondContact O-NH2 2.76Å; S390-R451 PolarHBondContact OG-NE 3.18Å; S390-R451 PolarHBondContact OG-NH2 3.5Å; S390-R451 VanDerWaalsContact OG-NH2 3.11Å; E447-R451 HydrophobicContact CB-CB 4.29Å; E447-R451 PolarHBondContact O-N 2.92Å; E447-R451 VanDerWaalsContact O-N 3.1Å; E447-R451 WeakPolarHBondContact OE1-CD 3.49Å; E447-R451 IonicContact OE1-NH1 3.77Å; E447-R451 PolarHBondContact OE1-NH1 3.42Å; E447-R451 WeakPolarHBondContact OE2-CD 3.47Å; E447-R451 IonicContact OE2-NE 2.73Å; R451-Y501 WeakPolarHBondContact O-CD1 3.27Å
452	A	73.2	Confident	61.5	Low	2 Å²	2	64.2 Å²	64.2	2%	0.017	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-76.4	118.1	173	0	0	0	0	0	112.2	K392 Q393 T395 Y501	K392-A452 PolarHBondContact O-N 3.36Å; Q393-A452 VanDerWaalsContact C-CB 3.45Å; Q393-A452 WeakPolarHBondContact O-CB 3.17Å; T395-A452 PolarHBondContact OG1-O 2.99Å; A452-Y501 HydrophobicContact CB-CD1 4.49Å; A452-Y501 HydrophobicContact CB-CD2 3.61Å; A452-Y501 HydrophobicContact CB-CE1 4.49Å; A452-Y501 HydrophobicContact CB-CE2 3.67Å; A452-Y501 HydrophobicContact CB-CG 4.1Å
453	P	78.3	Confident	63.5	Low	29 Å²	29	57.8 Å²	57.8	19%	0.188	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-69.3	156	-176.2	31.9	-40.1	0	0	0	112.6	R482 A483	P453-R482 WeakPolarHBondContact CD-O 3.44Å; P453-R482 WeakPolarHBondContact CG-O 3.45Å; P453-A483 WeakPolarHBondContact CG-O 3.34Å
454	Q	68.4	Low	65.2	Low	91 Å²	91	54.1 Å²	54.1	43%	0.425	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-63.7	134.6	159.2	-171.1	176.1	-0.6	0	0	109	T395 E397 G485	T395-Q454 HydrophobicContact CG2-CB 4.07Å; T395-Q454 HydrophobicContact CG2-CG 4.2Å; E397-Q454 PolarHBondContact OE1-NE2 2.74Å; Q454-G485 WeakPolarHBondContact O-CA 3.47Å
455	W	75.8	Confident	66.8	Low	60 Å²	60	46 Å²	46	23%	0.227	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-93.4	139.1	178.3	-78.2	21.9	0	0	0	110.4	F331 H480	F331-W455 HydrophobicContact CD1-CB 4.29Å; F331-W455 VanDerWaalsContact CD1-O 3.28Å; F331-W455 WeakPolarHBondContact CD1-O 3.44Å; F331-W455 HydrophobicContact CE1-CB 4.34Å; F331-W455 WeakPolarHBondContact CE1-O 3.3Å; W455-H480 HydrophobicContact CD2-CB 3.74Å; W455-H480 AromaticContact CD2-CD2 3.82Å; W455-H480 AromaticContact CD2-CG 3.76Å; W455-H480 HydrophobicContact CE3-CB 3.57Å; W455-H480 AromaticContact CE3-CD2 3.55Å; W455-H480 AromaticContact CE3-CG 3.26Å; W455-H480 AromaticContact CE3-ND1 3.69Å; W455-H480 HydrophobicContact CH2-CB 3.82Å; W455-H480 HydrophobicContact CZ2-CB 3.97Å; W455-H480 HydrophobicContact CZ3-CB 3.62Å; W455-H480 AromaticContact CZ3-CG 3.58Å; W455-H480 AromaticContact CZ3-ND1 3.73Å
456	V	69.2	Low	68.4	Low	22 Å²	22	46.4 Å²	46.4	13%	0.133	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-76.7	130.9	175.1	-179.8	0	0	0	0	109.3	M460 V461 M465 H480 G485 V487 Q584	V456-M460 HydrophobicContact CG1-CB 4.02Å; V456-V461 HydrophobicContact CG1-CG2 4.03Å; V456-M465 HydrophobicContact CB-CE 4.49Å; V456-M465 HydrophobicContact CB-SD 4.43Å; V456-M465 HydrophobicContact CG1-CE 4.18Å; V456-M465 HydrophobicContact CG1-SD 4.49Å; V456-M465 HydrophobicContact CG2-CE 4.07Å; V456-M465 HydrophobicContact CG2-SD 4.29Å; V456-H480 PolarHBondContact O-NE2 2.75Å; V456-G485 PolarHBondContact N-O 2.75Å; V456-V487 HydrophobicContact CB-CG2 4.11Å; V456-V487 HydrophobicContact CG1-CG2 4.42Å; V456-Q584 HydrophobicContact CG1-CB 3.93Å; V456-Q584 HydrophobicContact CG1-CG 3.98Å
457	R	63.3	Low	69.6	Low	28 Å²	28	42.5 Å²	42.5	11%	0.106	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-60.3	138.4	179.2	-56.9	-177	-163.7	156.6	11.5	109.8	F331 D380 E397 K459 M460	F331-R457 HydrophobicContact CD1-CB 4.41Å; F331-R457 HydrophobicContact CD1-CG 3.74Å; F331-R457 HydrophobicContact CE1-CG 4.33Å; D380-R457 IonicContact OD2-CZ 3.11Å; D380-R457 VanDerWaalsContact OD2-CZ 3.26Å; D380-R457 IonicContact OD2-NH1 2.75Å; D380-R457 PolarHBondContact OD2-NH1 3.16Å; D380-R457 IonicContact OD2-NH2 2.67Å; D380-R457 PolarHBondContact OD2-NH2 3.29Å; E397-R457 IonicContact OE2-CZ 2.74Å; E397-R457 IonicContact OE2-NE 3.6Å; E397-R457 PolarHBondContact OE2-NE 2.88Å; E397-R457 VanDerWaalsContact OE2-NE 3.08Å; E397-R457 IonicContact OE2-NH2 2.81Å; E397-R457 PolarHBondContact OE2-NH2 3.47Å; R457-K459 PolarHBondContact O-N 3.18Å; R457-M460 HydrophobicContact CB-CG 4.07Å; R457-M460 HydrophobicContact CB-SD 3.9Å; R457-M460 HydrophobicContact CG-CE 4.42Å; R457-M460 HydrophobicContact CG-SD 3.91Å; R457-M460 PolarHBondContact O-N 3Å
458	D	64.6	Low	70.1	Confident	35 Å²	35	40.9 Å²	40.9	19%	0.187	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-59.4	-23.9	-177.1	-80.4	-42.7	0	0	0	113.5	F331 R332 R478 H480	F331-D458 PolarHBondContact O-N 3Å; R332-D458 IonicContact NE-OD2 3.46Å; D458-R478 PolarHBondContact O-NE 2.76Å; D458-R478 VanDerWaalsContact O-NE 3.13Å; D458-R478 WeakPolarHBondContact OD1-CD 3.4Å; D458-H480 IonicContact OD1-CE1 2.72Å; D458-H480 PolarHBondContact OD1-CE1 2.91Å; D458-H480 VanDerWaalsContact OD1-CE1 3.23Å; D458-H480 IonicContact OD1-NE2 3.57Å; D458-H480 IonicContact OD2-CE1 3.46Å
459	K	60.8	Low	70	Confident	145 Å²	145	44.2 Å²	44.2	63%	0.63	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-77.1	-22.1	175	-73.8	-173	163.6	-165.7	0	114.9	N334 R457 V461	N334-K459 WeakPolarHBondContact OD1-CE 3.45Å; N334-K459 PolarHBondContact OD1-NZ 3.17Å; R457-K459 PolarHBondContact O-N 3.18Å; K459-V461 PolarHBondContact O-N 2.98Å
460	M	55.8	Low	70.3	Confident	50 Å²	50	48 Å²	48	25%	0.246	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-80.8	-4.6	-176.8	-73.2	171.4	162.2	0	0	113.1	V456 R457 A582 Q584	V456-M460 HydrophobicContact CG1-CB 4.02Å; R457-M460 HydrophobicContact CB-CG 4.07Å; R457-M460 HydrophobicContact CB-SD 3.9Å; R457-M460 HydrophobicContact CG-CE 4.42Å; R457-M460 HydrophobicContact CG-SD 3.91Å; R457-M460 PolarHBondContact O-N 3Å; M460-A582 VanDerWaalsContact C-CB 3.42Å; M460-A582 CarbonylContact O-C 3.2Å; M460-A582 WeakPolarHBondContact O-CB 3.4Å; M460-Q584 HydrophobicContact CB-CB 4.09Å; M460-Q584 HydrophobicContact CB-CG 3.79Å; M460-Q584 HydrophobicContact CG-CG 4.47Å; M460-Q584 WeakPolarHBondContact O-CA 3.45Å; M460-Q584 WeakPolarHBondContact O-CB 3.44Å; M460-Q584 PolarHBondContact O-N 2.8Å; M460-Q584 HydrophobicContact SD-CG 4.35Å
461	V	62.7	Low	70.4	Confident	1 Å²	1	45 Å²	45	1%	0.006	22%	0.221	C	C	.	.			trans	-138.4	128.8	-177	-99.3	0	0	0	0	111.8	V456 K459 M465 R478 V487 Q584 D585	V456-V461 HydrophobicContact CG1-CG2 4.03Å; K459-V461 PolarHBondContact O-N 2.98Å; V461-M465 HydrophobicContact CG1-CE 3.77Å; V461-M465 HydrophobicContact CG1-CG 3.81Å; V461-M465 HydrophobicContact CG1-SD 4Å; V461-R478 PolarHBondContact O-NE 2.92Å; V461-R478 PolarHBondContact O-NH2 3.05Å; V461-V487 HydrophobicContact CG2-CB 3.8Å; V461-V487 HydrophobicContact CG2-CG1 4.44Å; V461-V487 HydrophobicContact CG2-CG2 3.52Å; V461-Q584 HydrophobicContact CG1-CB 4.01Å; V461-Q584 WeakPolarHBondContact CG1-O 3.48Å; V461-D585 WeakPolarHBondContact CA-OD1 3.49Å
462	T	66.1	Low	70.4	Confident	46 Å²	46	47 Å²	47	28%	0.282	23%	0.233	S	C	.	.	S	Bend	trans	-91.7	-24.8	169.9	68.3	0	0	0	0	112.3	F471 A581 A582 D585	T462-F471 WeakPolarHBondContact O-CD2 3.48Å; T462-F471 PolarHBondContact O-N 3.37Å; T462-A581 HydrophobicContact CG2-CB 3.56Å; T462-A582 HydrophobicContact CG2-CB 3.89Å; T462-D585 PolarHBondContact N-OD1 3.03Å; T462-D585 VanDerWaalsContact OG1-CG 3.32Å; T462-D585 PolarHBondContact OG1-OD1 3.2Å; T462-D585 PolarHBondContact OG1-OD2 3.5Å
463	M	72.4	Confident	69.9	Low	19 Å²	19	50.8 Å²	50.8	9%	0.094	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-123.8	161.1	-172.4	68.3	-175.8	66.2	0	0	114.6	M465 Q468 F471 D585 R587	M463-M465 PolarHBondContact O-N 3.28Å; M463-Q468 WeakPolarHBondContact CB-O 3.27Å; M463-Q468 HydrophobicContact SD-CB 4.43Å; M463-F471 WeakPolarHBondContact O-CE2 3.2Å; M463-D585 HydrophobicContact CE-CB 3.87Å; M463-D585 HydrophobicContact CG-CB 4.22Å; M463-D585 WeakPolarHBondContact CG-OD1 3.41Å; M463-D585 PolarHBondContact N-OD1 2.86Å; M463-D585 HydrophobicContact SD-CB 4.11Å; M463-R587 HydrophobicContact CE-CB 4.46Å; M463-R587 WeakPolarHBondContact CE-O 3.24Å; M463-R587 HydrophobicContact SD-CB 3.96Å
464	C	74.3	Confident	69.1	Low	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.293	C	S	.	.			trans	-69.1	117.9	177.6	179.9	0	0	0	0	111.5	R466 C467 Q468 E469 F471 C489	C464-R466 PolarHBondContact O-N 2.89Å; C464-C467 PolarHBondContact O-N 3.08Å; C464-Q468 WeakPolarHBondContact O-CA 3.32Å; C464-Q468 PolarHBondContact O-N 2.86Å; C464-E469 WeakPolarHBondContact CB-O 3.36Å; C464-E469 PolarHBondContact N-O 3.08Å; C464-F471 HydrophobicContact CB-CE1 4.12Å; C464-F471 HydrophobicContact CB-CZ 3.97Å; C464-C489 HydrophobicContact CB-CB 4.48Å; C464-C489 PolarHBondContact SG-N 2.95Å
465	M	74.3	Confident	69	Low	8 Å²	8	58.1 Å²	58.1	4%	0.039	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	30.2	-178.4	-54.7	175.9	110.8	0	0	114.8	V456 V461 M463 Y486 V487 Q584 M586	V456-M465 HydrophobicContact CB-CE 4.49Å; V456-M465 HydrophobicContact CB-SD 4.43Å; V456-M465 HydrophobicContact CG1-CE 4.18Å; V456-M465 HydrophobicContact CG1-SD 4.49Å; V456-M465 HydrophobicContact CG2-CE 4.07Å; V456-M465 HydrophobicContact CG2-SD 4.29Å; V461-M465 HydrophobicContact CG1-CE 3.77Å; V461-M465 HydrophobicContact CG1-CG 3.81Å; V461-M465 HydrophobicContact CG1-SD 4Å; M463-M465 PolarHBondContact O-N 3.28Å; M465-Y486 HydrophobicContact CB-CD2 3.81Å; M465-Y486 HydrophobicContact CB-CG 4.18Å; M465-Y486 HydrophobicContact SD-CD1 4.28Å; M465-Y486 HydrophobicContact SD-CD2 4.38Å; M465-Y486 HydrophobicContact SD-CG 3.9Å; M465-V487 WeakPolarHBondContact CB-O 3.46Å; M465-V487 WeakPolarHBondContact CG-O 3.33Å; M465-V487 PolarHBondContact N-O 3.02Å; M465-V487 HydrophobicContact SD-CB 4.38Å; M465-V487 PolarHBondContact SD-N 3.41Å; M465-Q584 HydrophobicContact CE-CB 3.91Å; M465-Q584 WeakPolarHBondContact CE-O 3.5Å; M465-M586 HydrophobicContact CB-CG 4.24Å; M465-M586 HydrophobicContact CG-CG 4.44Å
466	R	79.8	Confident	69	Low	85 Å²	85	57.4 Å²	57.4	32%	0.321	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.7	-48.4	174.2	-71.9	-60.6	178.4	-167.2	1.9	112.6	C464 V488 C492 C510 H512	C464-R466 PolarHBondContact O-N 2.89Å; R466-V488 HydrophobicContact CB-CG1 4.26Å; R466-V488 HydrophobicContact CG-CG1 3.65Å; R466-C492 HydrophobicContact CB-CB 4.07Å; R466-C510 HydrophobicContact CG-CB 4.12Å; R466-C510 PolarHBondContact NE-SG 3.4Å; R466-C510 PolarHBondContact NH2-SG 3.18Å; R466-C510 VanDerWaalsContact NH2-SG 3.43Å; R466-H512 PolarHBondContact NH1-CD2 2.71Å
467	C	75.3	Confident	69.3	Low	48 Å²	48	64 Å²	64	32%	0.324	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	9.6	177.1	73.6	0	0	0	0	114.3	C464 E469 R476	C464-C467 PolarHBondContact O-N 3.08Å; C467-E469 PolarHBondContact O-N 3.34Å; C467-R476 PolarHBondContact SG-NH1 3.32Å
468	Q	72.3	Confident	70.1	Confident	46 Å²	46	67.1 Å²	67.1	22%	0.215	34%	0.341	C	S	.	.			trans	57.7	-5.4	178.2	-54.8	172.5	15.1	0	0	117.2	M463 C464 E535	M463-Q468 WeakPolarHBondContact CB-O 3.27Å; M463-Q468 HydrophobicContact SD-CB 4.43Å; C464-Q468 WeakPolarHBondContact O-CA 3.32Å; C464-Q468 PolarHBondContact O-N 2.86Å; Q468-E535 PolarHBondContact NE2-OE2 2.81Å
469	E	71.3	Confident	70.9	Confident	101 Å²	101	68.3 Å²	68.3	47%	0.472	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-66.1	133.4	178.7	-73.9	-70.8	134.1	0	0	113	C464 C467	C464-E469 WeakPolarHBondContact CB-O 3.36Å; C464-E469 PolarHBondContact N-O 3.08Å; C467-E469 PolarHBondContact O-N 3.34Å
470	P	72.4	Confident	71.8	Confident	83 Å²	83	61.5 Å²	61.5	54%	0.539	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-58.1	142.1	179.6	-26.6	35.1	0	0	0	114.7	R476	P470-R476 WeakPolarHBondContact O-CD 3.43Å
471	F	75.1	Confident	73.1	Confident	21 Å²	21	59.1 Å²	59.1	9%	0.092	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-76.8	144	171.2	-68	-64.7	0	0	0	111.9	T462 M463 C464 R476 R478 V487 C489	T462-F471 WeakPolarHBondContact O-CD2 3.48Å; T462-F471 PolarHBondContact O-N 3.37Å; M463-F471 WeakPolarHBondContact O-CE2 3.2Å; C464-F471 HydrophobicContact CB-CE1 4.12Å; C464-F471 HydrophobicContact CB-CZ 3.97Å; F471-R476 WeakPolarHBondContact CA-O 3.18Å; F471-R476 HydrophobicContact CD1-CG 4.4Å; F471-R476 WeakPolarHBondContact CD1-O 3Å; F471-R478 HydrophobicContact CB-CG 4.18Å; F471-R478 HydrophobicContact CD1-CG 3.82Å; F471-R478 HydrophobicContact CD2-CG 3.6Å; F471-R478 HydrophobicContact CE1-CB 4.47Å; F471-R478 HydrophobicContact CE1-CG 4.01Å; F471-R478 HydrophobicContact CE2-CG 3.79Å; F471-R478 HydrophobicContact CG-CG 3.62Å; F471-R478 HydrophobicContact CZ-CG 4Å; F471-V487 HydrophobicContact CE2-CB 4.27Å; F471-V487 HydrophobicContact CE2-CG1 3.77Å; F471-V487 HydrophobicContact CZ-CB 4.31Å; F471-V487 HydrophobicContact CZ-CG1 3.7Å; F471-C489 HydrophobicContact CE1-CB 4.14Å
472	N	73.5	Confident	74.2	Confident	67 Å²	67	62.5 Å²	62.5	36%	0.358	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-139.6	156.3	171.8	77	63.4	0	0	0	111	L474 T475 R476	N472-L474 VanDerWaalsContact C-N 3.32Å; N472-L474 PolarHBondContact O-N 2.95Å; N472-L474 PolarHBondContact OD1-N 3.23Å; N472-L474 VanDerWaalsContact OD1-N 3.15Å; N472-T475 PolarHBondContact ND2-OG1 3.04Å; N472-T475 PolarHBondContact OD1-N 3.04Å; N472-T475 PolarHBondContact OD1-OG1 3.26Å; N472-R476 PolarHBondContact N-O 2.92Å; N472-R476 WeakPolarHBondContact ND2-CB 3.43Å; N472-R476 CarbonylContact O-C 3.53Å; N472-R476 PolarHBondContact O-N 3.17Å; N472-R476 PolarHBondContact OD1-N 3.11Å
473	A	62.3	Low	74.8	Confident	81 Å²	81	60.5 Å²	60.5	67%	0.669	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-27.2	-169.9	0	0	0	0	0	114.7	R477	A473-R477 PolarHBondContact O-NE 2.79Å
474	L	60.7	Low	74.9	Confident	150 Å²	150	60.8 Å²	60.8	79%	0.785	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-56.1	-169.6	-64.3	175.3	0	0	0	112.4	N472	N472-L474 VanDerWaalsContact C-N 3.32Å; N472-L474 PolarHBondContact O-N 2.95Å; N472-L474 PolarHBondContact OD1-N 3.23Å; N472-L474 VanDerWaalsContact OD1-N 3.15Å
475	T	67.6	Low	74.9	Confident	125 Å²	125	60.8 Å²	60.8	77%	0.767	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-20	-170.8	64.3	0	0	0	0	114.5	N472	N472-T475 PolarHBondContact ND2-OG1 3.04Å; N472-T475 PolarHBondContact OD1-N 3.04Å; N472-T475 PolarHBondContact OD1-OG1 3.26Å
476	R	74.8	Confident	75.3	Confident	45 Å²	45	64.2 Å²	64.2	17%	0.17	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-135.9	72.1	-173.8	-164.3	175.8	-106.1	-87	8.7	111.9	C467 P470 F471 N472 C489	C467-R476 PolarHBondContact SG-NH1 3.32Å; P470-R476 WeakPolarHBondContact O-CD 3.43Å; F471-R476 WeakPolarHBondContact CA-O 3.18Å; F471-R476 HydrophobicContact CD1-CG 4.4Å; F471-R476 WeakPolarHBondContact CD1-O 3Å; N472-R476 PolarHBondContact N-O 2.92Å; N472-R476 WeakPolarHBondContact ND2-CB 3.43Å; N472-R476 CarbonylContact O-C 3.53Å; N472-R476 PolarHBondContact O-N 3.17Å; N472-R476 PolarHBondContact OD1-N 3.11Å; R476-C489 HydrophobicContact CG-CB 4.02Å; R476-C489 PolarHBondContact NH1-SG 3.08Å
477	R	76.8	Confident	75.2	Confident	160 Å²	160	60.2 Å²	60.2	60%	0.604	31%	0.306	S	S	*	.			trans	-74.7	159.1	-179.1	-63.8	-178.8	178.6	169.7	2.8	113.1	A473 H479	A473-R477 PolarHBondContact O-NE 2.79Å; R477-H479 PolarHBondContact O-CD2 2.78Å
478	R	78.6	Confident	75.6	Confident	94 Å²	94	57.9 Å²	57.9	36%	0.355	29%	0.29	S	S	.	.			trans	-83.1	138.1	178.4	-71.8	179.6	175.3	70.8	0.1	111.8	D458 V461 F471 V487	D458-R478 PolarHBondContact O-NE 2.76Å; D458-R478 VanDerWaalsContact O-NE 3.13Å; D458-R478 WeakPolarHBondContact OD1-CD 3.4Å; V461-R478 PolarHBondContact O-NE 2.92Å; V461-R478 PolarHBondContact O-NH2 3.05Å; F471-R478 HydrophobicContact CB-CG 4.18Å; F471-R478 HydrophobicContact CD1-CG 3.82Å; F471-R478 HydrophobicContact CD2-CG 3.6Å; F471-R478 HydrophobicContact CE1-CB 4.47Å; F471-R478 HydrophobicContact CE1-CG 4.01Å; F471-R478 HydrophobicContact CE2-CG 3.79Å; F471-R478 HydrophobicContact CG-CG 3.62Å; F471-R478 HydrophobicContact CZ-CG 4Å; R478-V487 HydrophobicContact CB-CG1 3.67Å; R478-V487 HydrophobicContact CG-CG1 3.73Å
479	H	82.2	Confident	76.2	Confident	59 Å²	59	55.9 Å²	55.9	27%	0.273	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.2	171.9	-49.9	-82.8	0	0	0	110.5	R477 V488 A490	R477-H479 PolarHBondContact O-CD2 2.78Å; H479-V488 WeakPolarHBondContact CB-O 3.02Å; H479-V488 PolarHBondContact N-O 2.9Å; H479-V488 WeakPolarHBondContact O-CG2 3.28Å; H479-V488 PolarHBondContact O-N 3.01Å; H479-V488 VanDerWaalsContact O-O 3.09Å; H479-A490 PolarHBondContact CD2-N 2.91Å
480	H	80.4	Confident	76.8	Confident	2 Å²	2	53 Å²	53	1%	0.009	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.2	175.1	-63.6	79.9	0	0	0	112.2	W455 V456 D458 R482 Y486	W455-H480 HydrophobicContact CD2-CB 3.74Å; W455-H480 AromaticContact CD2-CD2 3.82Å; W455-H480 AromaticContact CD2-CG 3.76Å; W455-H480 HydrophobicContact CE3-CB 3.57Å; W455-H480 AromaticContact CE3-CD2 3.55Å; W455-H480 AromaticContact CE3-CG 3.26Å; W455-H480 AromaticContact CE3-ND1 3.69Å; W455-H480 HydrophobicContact CH2-CB 3.82Å; W455-H480 HydrophobicContact CZ2-CB 3.97Å; W455-H480 HydrophobicContact CZ3-CB 3.62Å; W455-H480 AromaticContact CZ3-CG 3.58Å; W455-H480 AromaticContact CZ3-ND1 3.73Å; V456-H480 PolarHBondContact O-NE2 2.75Å; D458-H480 IonicContact OD1-CE1 2.72Å; D458-H480 PolarHBondContact OD1-CE1 2.91Å; D458-H480 VanDerWaalsContact OD1-CE1 3.23Å; D458-H480 IonicContact OD1-NE2 3.57Å; D458-H480 IonicContact OD2-CE1 3.46Å; H480-R482 WeakPolarHBondContact O-CD 3.47Å; H480-R482 PolarHBondContact O-NH1 2.8Å; H480-Y486 WeakPolarHBondContact CA-O 3.26Å
481	C	82.8	Confident	77.4	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.287	C	S	.	.			trans	-65.7	127.6	164.2	-179.6	0	0	0	0	109.2	G485 Y486 V488 C510	C481-G485 VanDerWaalsContact O-CA 3.27Å; C481-G485 WeakPolarHBondContact O-CA 3.34Å; C481-G485 PolarHBondContact O-N 3.3Å; C481-Y486 PolarHBondContact N-O 3.33Å; C481-V488 HydrophobicContact CB-CG2 4.33Å; C481-C510 HydrophobicContact CB-CB 4.36Å; C481-C510 PolarHBondContact SG-N 2.91Å
482	R	85.6	Confident	77.8	Confident	73 Å²	73	59 Å²	59	28%	0.275	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-28.5	-179.8	-84.2	53.8	159.4	-173.5	-5.8	113.3	P453 H480 L499 Y501 N507 R508	P453-R482 WeakPolarHBondContact CD-O 3.44Å; P453-R482 WeakPolarHBondContact CG-O 3.45Å; H480-R482 WeakPolarHBondContact O-CD 3.47Å; H480-R482 PolarHBondContact O-NH1 2.8Å; R482-L499 HydrophobicContact CB-CD1 3.57Å; R482-Y501 PolarHBondContact O-OH 2.9Å; R482-N507 HydrophobicContact CB-CB 3.98Å; R482-N507 HydrophobicContact CG-CB 4.08Å; R482-R508 WeakPolarHBondContact CB-O 3.2Å; R482-R508 WeakPolarHBondContact CD-O 3.42Å; R482-R508 PolarHBondContact N-O 3.47Å
483	A	78.3	Confident	78.5	Confident	3 Å²	3	55.8 Å²	55.8	3%	0.025	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-42.1	-178.7	0	0	0	0	0	113.8	L448 P453 L499 V509 C513 L517	L448-A483 HydrophobicContact CD1-CB 4.02Å; L448-A483 WeakPolarHBondContact CD1-O 3.26Å; L448-A483 HydrophobicContact CG-CB 4.25Å; P453-A483 WeakPolarHBondContact CG-O 3.34Å; A483-L499 HydrophobicContact CB-CD2 4.01Å; A483-V509 HydrophobicContact CB-CG1 3.75Å; A483-C513 HydrophobicContact CB-CB 3.8Å; A483-L517 HydrophobicContact CB-CD1 3.87Å
484	C	75.6	Confident	79.6	Confident	25 Å²	25	57.1 Å²	57.1	17%	0.169	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	6.5	-176.8	72.6	0	0	0	0	115.5	L448 Y486	L448-C484 HydrophobicContact CD1-CB 4.07Å; C484-Y486 VanDerWaalsContact O-CD1 3.24Å; C484-Y486 WeakPolarHBondContact O-CD1 3.21Å; C484-Y486 PolarHBondContact O-N 2.95Å
485	G	74.2	Confident	81	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	24%	0.243	C	C	.	.			trans	69.8	-9	174	0	0	0	0	0	116.9	Q454 V456 C481	Q454-G485 WeakPolarHBondContact O-CA 3.47Å; V456-G485 PolarHBondContact N-O 2.75Å; C481-G485 VanDerWaalsContact O-CA 3.27Å; C481-G485 WeakPolarHBondContact O-CA 3.34Å; C481-G485 PolarHBondContact O-N 3.3Å
486	Y	82.1	Confident	82	Confident	81 Å²	81	55.2 Å²	55.2	32%	0.318	24%	0.236	S	C	.	.			trans	-60.8	146.9	179.9	-76.3	16	0	0	0	112.9	M465 H480 C481 C484	M465-Y486 HydrophobicContact CB-CD2 3.81Å; M465-Y486 HydrophobicContact CB-CG 4.18Å; M465-Y486 HydrophobicContact SD-CD1 4.28Å; M465-Y486 HydrophobicContact SD-CD2 4.38Å; M465-Y486 HydrophobicContact SD-CG 3.9Å; H480-Y486 WeakPolarHBondContact CA-O 3.26Å; C481-Y486 PolarHBondContact N-O 3.33Å; C484-Y486 VanDerWaalsContact O-CD1 3.24Å; C484-Y486 WeakPolarHBondContact O-CD1 3.21Å; C484-Y486 PolarHBondContact O-N 2.95Å
487	V	77.8	Confident	82.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	121.9	174.1	-163	0	0	0	0	110.2	V456 V461 M465 F471 R478	V456-V487 HydrophobicContact CB-CG2 4.11Å; V456-V487 HydrophobicContact CG1-CG2 4.42Å; V461-V487 HydrophobicContact CG2-CB 3.8Å; V461-V487 HydrophobicContact CG2-CG1 4.44Å; V461-V487 HydrophobicContact CG2-CG2 3.52Å; M465-V487 WeakPolarHBondContact CB-O 3.46Å; M465-V487 WeakPolarHBondContact CG-O 3.33Å; M465-V487 PolarHBondContact N-O 3.02Å; M465-V487 HydrophobicContact SD-CB 4.38Å; M465-V487 PolarHBondContact SD-N 3.41Å; F471-V487 HydrophobicContact CE2-CB 4.27Å; F471-V487 HydrophobicContact CE2-CG1 3.77Å; F471-V487 HydrophobicContact CZ-CB 4.31Å; F471-V487 HydrophobicContact CZ-CG1 3.7Å; R478-V487 HydrophobicContact CB-CG1 3.67Å; R478-V487 HydrophobicContact CG-CG1 3.73Å
488	V	83.8	Confident	83.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	156	-169.9	-74.2	0	0	0	0	111.1	R466 H479 C481 C492 S493 C510	R466-V488 HydrophobicContact CB-CG1 4.26Å; R466-V488 HydrophobicContact CG-CG1 3.65Å; H479-V488 WeakPolarHBondContact CB-O 3.02Å; H479-V488 PolarHBondContact N-O 2.9Å; H479-V488 WeakPolarHBondContact O-CG2 3.28Å; H479-V488 PolarHBondContact O-N 3.01Å; H479-V488 VanDerWaalsContact O-O 3.09Å; C481-V488 HydrophobicContact CB-CG2 4.33Å; V488-C492 HydrophobicContact CB-CB 4.4Å; V488-S493 VanDerWaalsContact CG2-CB 3.48Å; V488-C510 HydrophobicContact CG1-CB 4.24Å; V488-C510 HydrophobicContact CG2-CB 4.48Å
489	C	84.3	Confident	83.4	Confident	4 Å²	4	47 Å²	47	3%	0.027	21%	0.211	C	C	.	.			trans	-81.6	167.1	173.9	78	0	0	0	0	111.5	C464 F471 R476 R491 C492 S493	C464-C489 HydrophobicContact CB-CB 4.48Å; C464-C489 PolarHBondContact SG-N 2.95Å; F471-C489 HydrophobicContact CE1-CB 4.14Å; R476-C489 HydrophobicContact CG-CB 4.02Å; R476-C489 PolarHBondContact NH1-SG 3.08Å; C489-R491 PolarHBondContact O-N 3.05Å; C489-C492 PolarHBondContact O-N 2.82Å; C489-C492 PolarHBondContact SG-N 3.05Å; C489-S493 PolarHBondContact O-N 2.85Å; C489-S493 PolarHBondContact O-OG 2.6Å
490	A	83.8	Confident	83.2	Confident	41 Å²	41	51.3 Å²	51.3	34%	0.339	23%	0.229	S	C	.	.	S	Bend	trans	-53.2	-51	177.6	0	0	0	0	0	112.5	H479 C492 S493 D494	H479-A490 PolarHBondContact CD2-N 2.91Å; A490-C492 VanDerWaalsContact C-N 3.28Å; A490-C492 PolarHBondContact O-N 2.76Å; A490-S493 CarbonylContact O-C 3.57Å; A490-S493 PolarHBondContact O-N 2.79Å; A490-D494 PolarHBondContact O-N 2.7Å
491	R	84.8	Confident	83.1	Confident	208 Å²	208	52.2 Å²	52.2	79%	0.785	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.6	179.7	-66.6	-176	68.3	-170.5	-0.7	113.6	C489 S493	C489-R491 PolarHBondContact O-N 3.05Å; R491-S493 VanDerWaalsContact C-N 3.27Å; R491-S493 PolarHBondContact O-N 2.84Å
492	C	82.9	Confident	82.8	Confident	21 Å²	21	53.6 Å²	53.6	14%	0.142	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.3	178.4	-64.8	0	0	0	0	113.6	R466 V488 C489 A490 C510 L511	R466-C492 HydrophobicContact CB-CB 4.07Å; V488-C492 HydrophobicContact CB-CB 4.4Å; C489-C492 PolarHBondContact O-N 2.82Å; C489-C492 PolarHBondContact SG-N 3.05Å; A490-C492 VanDerWaalsContact C-N 3.28Å; A490-C492 PolarHBondContact O-N 2.76Å; C492-C510 WeakPolarHBondContact O-CA 3.37Å; C492-C510 WeakPolarHBondContact O-CB 3.39Å; C492-L511 PolarHBondContact O-N 3.24Å
493	S	88.3	Confident	82.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-145.9	25.5	-170.3	67.6	0	0	0	0	115.1	V488 C489 A490 R491 Y495 R508 V509	V488-S493 VanDerWaalsContact CG2-CB 3.48Å; C489-S493 PolarHBondContact O-N 2.85Å; C489-S493 PolarHBondContact O-OG 2.6Å; A490-S493 CarbonylContact O-C 3.57Å; A490-S493 PolarHBondContact O-N 2.79Å; R491-S493 VanDerWaalsContact C-N 3.27Å; R491-S493 PolarHBondContact O-N 2.84Å; S493-Y495 PolarHBondContact O-N 3.32Å; S493-R508 VanDerWaalsContact C-NH1 3.31Å; S493-R508 VanDerWaalsContact O-CD 3.27Å; S493-R508 WeakPolarHBondContact O-CD 3.39Å; S493-R508 WeakPolarHBondContact O-CG 3.02Å; S493-R508 PolarHBondContact O-NH1 2.82Å; S493-V509 CarbonylContact C-O 3.59Å; S493-V509 VanDerWaalsContact CA-O 3.27Å; S493-V509 WeakPolarHBondContact CA-O 3.5Å
494	D	86.9	Confident	82.4	Confident	109 Å²	109	57.4 Å²	57.4	58%	0.583	27%	0.266	S	S	*	.			trans	-78.7	-6.1	179.7	-121.7	22.7	0	0	0	114.2	A490 R508	A490-D494 PolarHBondContact O-N 2.7Å; D494-R508 IonicContact OD1-CZ 3.26Å; D494-R508 VanDerWaalsContact OD1-CZ 3.32Å; D494-R508 IonicContact OD1-NH1 3.1Å; D494-R508 PolarHBondContact OD1-NH1 2.96Å; D494-R508 IonicContact OD1-NH2 2.78Å; D494-R508 PolarHBondContact OD1-NH2 3.45Å
495	Y	88.5	Confident	82.6	Confident	67 Å²	67	63.5 Å²	63.5	26%	0.263	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	150.8	176.7	-44.9	-83.1	0	0	0	112	S493 V509 L511 Y514 L522	S493-Y495 PolarHBondContact O-N 3.32Å; Y495-V509 PolarHBondContact O-N 2.78Å; Y495-L511 HydrophobicContact CD1-CD1 4.45Å; Y495-L511 HydrophobicContact CD2-CB 4.04Å; Y495-L511 HydrophobicContact CE1-CD1 3.96Å; Y495-L511 HydrophobicContact CE2-CB 3.62Å; Y495-L511 HydrophobicContact CE2-CD1 4.12Å; Y495-L511 HydrophobicContact CE2-CG 4.36Å; Y495-Y514 AromaticContact CD1-CD1 3.92Å; Y495-Y514 HydrophobicContact CD1-CD1 3.92Å; Y495-Y514 HydrophobicContact CD1-CE1 4.35Å; Y495-Y514 HydrophobicContact CD1-CG 4.19Å; Y495-Y514 HydrophobicContact CG-CD1 4.29Å; Y495-Y514 HydrophobicContact CG-CG 4.12Å; Y495-L522 HydrophobicContact CD1-CD1 4.08Å; Y495-L522 HydrophobicContact CE1-CD1 3.52Å
496	R	90.3	Very high	83.2	Confident	167 Å²	167	66.8 Å²	66.8	63%	0.63	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.2	169.8	-69.1	-176.4	179.2	-133.4	16.7	110.1	P506 N507 Y514	R496-P506 HydrophobicContact CB-CB 4.26Å; R496-P506 PolarHBondContact NH1-O 3.39Å; R496-N507 VanDerWaalsContact CA-O 3.25Å; R496-N507 WeakPolarHBondContact CA-O 3.48Å; R496-Y514 VanDerWaalsContact O-CD2 3.31Å; R496-Y514 WeakPolarHBondContact O-CD2 3.5Å; R496-Y514 WeakPolarHBondContact O-CE2 3.16Å
497	A	87.8	Confident	83.5	Confident	3 Å²	3	64.3 Å²	64.3	3%	0.025	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.6	171.2	0	0	0	0	0	109.3	N507 V509 Y514 L517 T518	A497-N507 PolarHBondContact N-O 2.78Å; A497-N507 VanDerWaalsContact N-O 3.1Å; A497-N507 PolarHBondContact O-N 2.94Å; A497-V509 HydrophobicContact CB-CG1 4.26Å; A497-V509 HydrophobicContact CB-CG2 3.71Å; A497-Y514 HydrophobicContact CB-CD2 4.26Å; A497-L517 HydrophobicContact CB-CB 3.98Å; A497-L517 HydrophobicContact CB-CD1 3.68Å; A497-T518 HydrophobicContact CB-CG2 4.12Å
498	E	87.4	Confident	84.1	Confident	123 Å²	123	67.6 Å²	67.6	58%	0.575	31%	0.311	S	S	*	.			trans	-73.8	139.7	171	-60	-162.3	164.1	0	0	109.3	N504	E498-N504 WeakPolarHBondContact CA-O 3.44Å; E498-N504 HydrophobicContact CB-CB 4.33Å; E498-N504 WeakPolarHBondContact CB-O 3.35Å; E498-N504 WeakPolarHBondContact CG-O 3.32Å
499	L	83.3	Confident	84.4	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	31%	0.311	C	S	.	.			trans	-129.1	116.2	-177.3	-57.7	175	0	0	0	108.8	G449 R482 A483 Y501 N502 N504 N507 V509 L517	G449-L499 CarbonylContact O-C 3.58Å; R482-L499 HydrophobicContact CB-CD1 3.57Å; A483-L499 HydrophobicContact CB-CD2 4.01Å; L499-Y501 VanDerWaalsContact C-N 3.25Å; L499-Y501 HydrophobicContact CB-CD1 4.04Å; L499-Y501 HydrophobicContact CB-CE1 3.8Å; L499-Y501 HydrophobicContact CD1-CE1 3.73Å; L499-Y501 WeakPolarHBondContact CD1-OH 3.35Å; L499-Y501 HydrophobicContact CG-CE1 4.24Å; L499-Y501 PolarHBondContact O-N 3.08Å; L499-N502 HydrophobicContact CB-CB 4.46Å; L499-N502 CarbonylContact O-C 3.15Å; L499-N502 PolarHBondContact O-N 2.78Å; L499-N504 WeakPolarHBondContact O-CA 3.49Å; L499-N504 PolarHBondContact O-N 3.19Å; L499-N504 VanDerWaalsContact O-N 3.15Å; L499-N507 HydrophobicContact CD1-CB 3.42Å; L499-N507 VanDerWaalsContact CD1-CB 3.42Å; L499-N507 HydrophobicContact CG-CB 4.05Å; L499-V509 HydrophobicContact CD1-CG1 4.5Å; L499-V509 HydrophobicContact CD2-CG1 4.4Å; L499-L517 HydrophobicContact CD2-CD1 3.46Å; L499-L517 VanDerWaalsContact CD2-CD1 3.46Å; L499-L517 HydrophobicContact CD2-CD2 4.45Å
500	K	77.9	Confident	84.5	Confident	150 Å²	150	67.4 Å²	67.4	65%	0.652	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-58.5	-33.3	-176.1	-79.1	170	170	177.2	0	112.9	G449 L450 N502 N504	G449-K500 PolarHBondContact O-N 2.85Å; L450-K500 HydrophobicContact CD2-CB 4.29Å; L450-K500 HydrophobicContact CD2-CD 3.45Å; L450-K500 VanDerWaalsContact CD2-CD 3.45Å; L450-K500 HydrophobicContact CD2-CG 4.44Å; K500-N502 PolarHBondContact O-N 3.07Å; K500-N504 WeakPolarHBondContact CA-OD1 3.35Å; K500-N504 VanDerWaalsContact CG-OD1 3.26Å; K500-N504 WeakPolarHBondContact CG-OD1 3.49Å
501	Y	78.8	Confident	84.4	Confident	21 Å²	21	68.9 Å²	68.9	8%	0.082	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-68.2	-10.7	175	80.6	-99.9	0	0	0	114.7	G449 L450 R451 A452 R482 L499	G449-Y501 WeakPolarHBondContact O-CD1 3.39Å; G449-Y501 PolarHBondContact O-N 2.8Å; L450-Y501 WeakPolarHBondContact O-CB 3.49Å; R451-Y501 WeakPolarHBondContact O-CD1 3.27Å; A452-Y501 HydrophobicContact CB-CD1 4.49Å; A452-Y501 HydrophobicContact CB-CD2 3.61Å; A452-Y501 HydrophobicContact CB-CE1 4.49Å; A452-Y501 HydrophobicContact CB-CE2 3.67Å; A452-Y501 HydrophobicContact CB-CG 4.1Å; R482-Y501 PolarHBondContact O-OH 2.9Å; L499-Y501 VanDerWaalsContact C-N 3.25Å; L499-Y501 HydrophobicContact CB-CD1 4.04Å; L499-Y501 HydrophobicContact CB-CE1 3.8Å; L499-Y501 HydrophobicContact CD1-CE1 3.73Å; L499-Y501 WeakPolarHBondContact CD1-OH 3.35Å; L499-Y501 HydrophobicContact CG-CE1 4.24Å; L499-Y501 PolarHBondContact O-N 3.08Å
502	N	77.2	Confident	84.3	Confident	29 Å²	29	64.3 Å²	64.3	16%	0.155	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-132.6	47.9	-172.9	-161	114.7	0	0	0	109.8	R394 L499 K500 N504 R505 N507	R394-N502 PolarHBondContact NH2-OD1 2.79Å; L499-N502 HydrophobicContact CB-CB 4.46Å; L499-N502 CarbonylContact O-C 3.15Å; L499-N502 PolarHBondContact O-N 2.78Å; K500-N502 PolarHBondContact O-N 3.07Å; N502-N504 PolarHBondContact O-N 3.19Å; N502-R505 WeakPolarHBondContact O-CB 3.31Å; N502-R505 WeakPolarHBondContact O-CG 3.43Å; N502-R505 PolarHBondContact O-N 3.17Å; N502-N507 PolarHBondContact ND2-ND2 3.18Å
503	D	75.5	Confident	84.2	Confident	79 Å²	79	63.4 Å²	63.4	42%	0.422	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	38	174.2	-16	-48.4	0	0	0	112.8	R505	D503-R505 HydrophobicContact CB-CG 4.25Å; D503-R505 WeakPolarHBondContact O-CG 3.48Å; D503-R505 PolarHBondContact O-N 3.16Å; D503-R505 IonicContact OD2-CZ 3.46Å; D503-R505 IonicContact OD2-NE 3.28Å; D503-R505 PolarHBondContact OD2-NE 3.45Å; D503-R505 IonicContact OD2-NH2 2.67Å; D503-R505 PolarHBondContact OD2-NH2 2.93Å
504	N	78.4	Confident	84.1	Confident	77 Å²	77	65.8 Å²	65.8	41%	0.412	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	11.7	-172.7	-58.1	-51.2	0	0	0	115.2	E498 L499 K500 N502	E498-N504 WeakPolarHBondContact CA-O 3.44Å; E498-N504 HydrophobicContact CB-CB 4.33Å; E498-N504 WeakPolarHBondContact CB-O 3.35Å; E498-N504 WeakPolarHBondContact CG-O 3.32Å; L499-N504 WeakPolarHBondContact O-CA 3.49Å; L499-N504 PolarHBondContact O-N 3.19Å; L499-N504 VanDerWaalsContact O-N 3.15Å; K500-N504 WeakPolarHBondContact CA-OD1 3.35Å; K500-N504 VanDerWaalsContact CG-OD1 3.26Å; K500-N504 WeakPolarHBondContact CG-OD1 3.49Å; N502-N504 PolarHBondContact O-N 3.19Å
505	R	80.6	Confident	83.8	Confident	153 Å²	153	62.5 Å²	62.5	58%	0.577	29%	0.286	S	S	*	.			trans	-65.7	140.7	-172.8	-57.2	-176.5	-154.1	-142.9	3.1	111.6	N502 D503 N507	N502-R505 WeakPolarHBondContact O-CB 3.31Å; N502-R505 WeakPolarHBondContact O-CG 3.43Å; N502-R505 PolarHBondContact O-N 3.17Å; D503-R505 HydrophobicContact CB-CG 4.25Å; D503-R505 WeakPolarHBondContact O-CG 3.48Å; D503-R505 PolarHBondContact O-N 3.16Å; D503-R505 IonicContact OD2-CZ 3.46Å; D503-R505 IonicContact OD2-NE 3.28Å; D503-R505 PolarHBondContact OD2-NE 3.45Å; D503-R505 IonicContact OD2-NH2 2.67Å; D503-R505 PolarHBondContact OD2-NH2 2.93Å; R505-N507 PolarHBondContact O-N 2.98Å; R505-N507 PolarHBondContact O-ND2 3.46Å
506	P	87.4	Confident	83.5	Confident	70 Å²	70	64.8 Å²	64.8	46%	0.455	30%	0.298	S	S	.	.			trans	-70.1	99.8	-175	26.7	-35.6	0	0	0	112.4	R496	R496-P506 HydrophobicContact CB-CB 4.26Å; R496-P506 PolarHBondContact NH1-O 3.39Å
507	N	88.2	Confident	83	Confident	29 Å²	29	59.1 Å²	59.1	16%	0.155	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	147.5	-169.8	-94	-78.9	0	0	0	112.3	R482 R496 A497 L499 N502 R505 V509	R482-N507 HydrophobicContact CB-CB 3.98Å; R482-N507 HydrophobicContact CG-CB 4.08Å; R496-N507 VanDerWaalsContact CA-O 3.25Å; R496-N507 WeakPolarHBondContact CA-O 3.48Å; A497-N507 PolarHBondContact N-O 2.78Å; A497-N507 VanDerWaalsContact N-O 3.1Å; A497-N507 PolarHBondContact O-N 2.94Å; L499-N507 HydrophobicContact CD1-CB 3.42Å; L499-N507 VanDerWaalsContact CD1-CB 3.42Å; L499-N507 HydrophobicContact CG-CB 4.05Å; N502-N507 PolarHBondContact ND2-ND2 3.18Å; R505-N507 PolarHBondContact O-N 2.98Å; R505-N507 PolarHBondContact O-ND2 3.46Å; N507-V509 PolarHBondContact O-N 3.4Å
508	R	90.8	Very high	82.8	Confident	69 Å²	69	61.5 Å²	61.5	26%	0.26	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	121	-178.9	-172.1	-178.2	-85.4	-94.6	-2.5	111.4	R482 S493 D494	R482-R508 WeakPolarHBondContact CB-O 3.2Å; R482-R508 WeakPolarHBondContact CD-O 3.42Å; R482-R508 PolarHBondContact N-O 3.47Å; S493-R508 VanDerWaalsContact C-NH1 3.31Å; S493-R508 VanDerWaalsContact O-CD 3.27Å; S493-R508 WeakPolarHBondContact O-CD 3.39Å; S493-R508 WeakPolarHBondContact O-CG 3.02Å; S493-R508 PolarHBondContact O-NH1 2.82Å; D494-R508 IonicContact OD1-CZ 3.26Å; D494-R508 VanDerWaalsContact OD1-CZ 3.32Å; D494-R508 IonicContact OD1-NH1 3.1Å; D494-R508 PolarHBondContact OD1-NH1 2.96Å; D494-R508 IonicContact OD1-NH2 2.78Å; D494-R508 PolarHBondContact OD1-NH2 3.45Å
509	V	88.6	Confident	82.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	157.5	-179.9	-68.1	0	0	0	0	111.3	A483 S493 Y495 A497 L499 N507 C513 Y514 L517	A483-V509 HydrophobicContact CB-CG1 3.75Å; S493-V509 CarbonylContact C-O 3.59Å; S493-V509 VanDerWaalsContact CA-O 3.27Å; S493-V509 WeakPolarHBondContact CA-O 3.5Å; Y495-V509 PolarHBondContact O-N 2.78Å; A497-V509 HydrophobicContact CB-CG1 4.26Å; A497-V509 HydrophobicContact CB-CG2 3.71Å; L499-V509 HydrophobicContact CD1-CG1 4.5Å; L499-V509 HydrophobicContact CD2-CG1 4.4Å; N507-V509 PolarHBondContact O-N 3.4Å; V509-C513 HydrophobicContact CB-CB 4.13Å; V509-Y514 HydrophobicContact CG2-CD2 4.4Å; V509-L517 HydrophobicContact CG1-CD1 4.33Å
510	C	87.5	Confident	81.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.315	C	S	.	.			trans	-78.4	155.9	170.9	71.5	0	0	0	0	111.7	R466 C481 V488 C492 H512 C513 Y514	R466-C510 HydrophobicContact CG-CB 4.12Å; R466-C510 PolarHBondContact NE-SG 3.4Å; R466-C510 PolarHBondContact NH2-SG 3.18Å; R466-C510 VanDerWaalsContact NH2-SG 3.43Å; C481-C510 HydrophobicContact CB-CB 4.36Å; C481-C510 PolarHBondContact SG-N 2.91Å; V488-C510 HydrophobicContact CG1-CB 4.24Å; V488-C510 HydrophobicContact CG2-CB 4.48Å; C492-C510 WeakPolarHBondContact O-CA 3.37Å; C492-C510 WeakPolarHBondContact O-CB 3.39Å; C510-H512 VanDerWaalsContact C-N 3.31Å; C510-H512 PolarHBondContact O-N 3.24Å; C510-C513 WeakPolarHBondContact O-CA 3.45Å; C510-C513 PolarHBondContact O-N 3.01Å; C510-C513 PolarHBondContact SG-SG 3.29Å; C510-Y514 PolarHBondContact O-N 3.24Å
511	L	82.3	Confident	80.7	Confident	71 Å²	71	60.9 Å²	60.9	37%	0.372	32%	0.32	S	S	.	.	H	α-helix	trans	-45.8	-51.5	-175.3	176	55.9	0	0	0	113.1	C492 Y495 C513 Y514 T515 L522	C492-L511 PolarHBondContact O-N 3.24Å; Y495-L511 HydrophobicContact CD1-CD1 4.45Å; Y495-L511 HydrophobicContact CD2-CB 4.04Å; Y495-L511 HydrophobicContact CE1-CD1 3.96Å; Y495-L511 HydrophobicContact CE2-CB 3.62Å; Y495-L511 HydrophobicContact CE2-CD1 4.12Å; Y495-L511 HydrophobicContact CE2-CG 4.36Å; L511-C513 VanDerWaalsContact C-N 3.28Å; L511-C513 PolarHBondContact O-N 3.43Å; L511-Y514 WeakPolarHBondContact O-CB 3.45Å; L511-Y514 PolarHBondContact O-N 2.88Å; L511-T515 PolarHBondContact O-N 3.08Å; L511-T515 PolarHBondContact O-OG1 2.88Å; L511-L522 HydrophobicContact CD1-CD1 3.98Å
512	H	80.9	Confident	79.9	Confident	113 Å²	113	63.5 Å²	63.5	52%	0.523	34%	0.335	S	S	.	.	H	α-helix	trans	-56.7	-38	178.8	-173.7	-48.7	0	0	0	113.4	R466 C510 F516	R466-H512 PolarHBondContact NH1-CD2 2.71Å; C510-H512 VanDerWaalsContact C-N 3.31Å; C510-H512 PolarHBondContact O-N 3.24Å; H512-F516 WeakPolarHBondContact O-CB 3.34Å; H512-F516 PolarHBondContact O-N 2.88Å
513	C	82.3	Confident	78.6	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.007	37%	0.366	C	S	.	.	H	α-helix	trans	-77.6	-32.9	176.2	-61.4	0	0	0	0	111.6	L448 A483 V509 C510 L511 L517	L448-C513 HydrophobicContact CD2-CB 4.23Å; A483-C513 HydrophobicContact CB-CB 3.8Å; V509-C513 HydrophobicContact CB-CB 4.13Å; C510-C513 WeakPolarHBondContact O-CA 3.45Å; C510-C513 PolarHBondContact O-N 3.01Å; C510-C513 PolarHBondContact SG-SG 3.29Å; L511-C513 VanDerWaalsContact C-N 3.28Å; L511-C513 PolarHBondContact O-N 3.43Å; C513-L517 HydrophobicContact CB-CD1 4.43Å; C513-L517 WeakPolarHBondContact O-CB 3.42Å; C513-L517 WeakPolarHBondContact O-CD1 3.48Å; C513-L517 WeakPolarHBondContact O-CG 3.39Å; C513-L517 PolarHBondContact O-N 2.84Å
514	Y	84.7	Confident	77.3	Confident	50 Å²	50	73 Å²	73	20%	0.196	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-48.5	174.2	177.7	-105.7	0	0	0	111.6	Y495 R496 A497 V509 C510 L511 L517 T518 N520 L522	Y495-Y514 AromaticContact CD1-CD1 3.92Å; Y495-Y514 HydrophobicContact CD1-CD1 3.92Å; Y495-Y514 HydrophobicContact CD1-CE1 4.35Å; Y495-Y514 HydrophobicContact CD1-CG 4.19Å; Y495-Y514 HydrophobicContact CG-CD1 4.29Å; Y495-Y514 HydrophobicContact CG-CG 4.12Å; R496-Y514 VanDerWaalsContact O-CD2 3.31Å; R496-Y514 WeakPolarHBondContact O-CD2 3.5Å; R496-Y514 WeakPolarHBondContact O-CE2 3.16Å; A497-Y514 HydrophobicContact CB-CD2 4.26Å; V509-Y514 HydrophobicContact CG2-CD2 4.4Å; C510-Y514 PolarHBondContact O-N 3.24Å; L511-Y514 WeakPolarHBondContact O-CB 3.45Å; L511-Y514 PolarHBondContact O-N 2.88Å; Y514-L517 PolarHBondContact O-N 3.42Å; Y514-T518 HydrophobicContact CD2-CG2 4.03Å; Y514-T518 HydrophobicContact CE2-CG2 3.88Å; Y514-T518 WeakPolarHBondContact O-CB 3.17Å; Y514-T518 PolarHBondContact O-N 3.29Å; Y514-T518 PolarHBondContact O-OG1 2.79Å; Y514-N520 HydrophobicContact CE1-CB 3.92Å; Y514-L522 HydrophobicContact CD1-CD1 4.36Å; Y514-L522 HydrophobicContact CE1-CD1 4.18Å
515	T	81.9	Confident	75.6	Confident	41 Å²	41	74.3 Å²	74.3	25%	0.252	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-45.6	177.2	-58.7	0	0	0	0	111.4	L511 G519 N520 V521	L511-T515 PolarHBondContact O-N 3.08Å; L511-T515 PolarHBondContact O-OG1 2.88Å; T515-G519 WeakPolarHBondContact O-CA 3.44Å; T515-G519 PolarHBondContact O-N 2.78Å; T515-N520 PolarHBondContact OG1-O 3.1Å; T515-V521 HydrophobicContact CG2-CG2 4.36Å
516	F	81.3	Confident	74	Confident	114 Å²	114	76.4 Å²	76.4	50%	0.5	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-49.1	176.1	-172.8	-81.6	0	0	0	112.7	S445 L448 H512 T518	S445-F516 WeakPolarHBondContact O-CZ 3.17Å; L448-F516 HydrophobicContact CB-CD1 4.3Å; L448-F516 HydrophobicContact CB-CE1 4.03Å; L448-F516 HydrophobicContact CD2-CB 4.15Å; L448-F516 HydrophobicContact CD2-CD1 3.55Å; L448-F516 HydrophobicContact CD2-CE1 4.1Å; L448-F516 HydrophobicContact CD2-CG 3.92Å; L448-F516 HydrophobicContact CG-CD1 4.46Å; H512-F516 WeakPolarHBondContact O-CB 3.34Å; H512-F516 PolarHBondContact O-N 2.88Å; F516-T518 VanDerWaalsContact C-N 3.33Å; F516-T518 PolarHBondContact O-N 3.46Å
517	L	81.3	Confident	71.8	Confident	48 Å²	48	79.7 Å²	79.7	25%	0.251	43%	0.431	S	S	.	.	H	α-helix	trans	-73.4	-20.1	-174	-71	167.5	0	0	0	114.4	L448 A483 A497 L499 V509 C513 Y514	L448-L517 HydrophobicContact CD2-CG 4.36Å; L448-L517 HydrophobicContact CG-CD2 4.45Å; L448-L517 VanDerWaalsContact O-CD2 3.24Å; L448-L517 WeakPolarHBondContact O-CD2 3.45Å; A483-L517 HydrophobicContact CB-CD1 3.87Å; A497-L517 HydrophobicContact CB-CB 3.98Å; A497-L517 HydrophobicContact CB-CD1 3.68Å; L499-L517 HydrophobicContact CD2-CD1 3.46Å; L499-L517 VanDerWaalsContact CD2-CD1 3.46Å; L499-L517 HydrophobicContact CD2-CD2 4.45Å; V509-L517 HydrophobicContact CG1-CD1 4.33Å; C513-L517 HydrophobicContact CB-CD1 4.43Å; C513-L517 WeakPolarHBondContact O-CB 3.42Å; C513-L517 WeakPolarHBondContact O-CD1 3.48Å; C513-L517 WeakPolarHBondContact O-CG 3.39Å; C513-L517 PolarHBondContact O-N 2.84Å; Y514-L517 PolarHBondContact O-N 3.42Å
518	T	81.7	Confident	69.4	Low	53 Å²	53	86.2 Å²	86.2	33%	0.325	47%	0.465	S	S	.	.	H	α-helix	trans	-124.2	-4	-172.5	69.8	0	0	0	0	114.3	A497 Y514 F516 N520	A497-T518 HydrophobicContact CB-CG2 4.12Å; Y514-T518 HydrophobicContact CD2-CG2 4.03Å; Y514-T518 HydrophobicContact CE2-CG2 3.88Å; Y514-T518 WeakPolarHBondContact O-CB 3.17Å; Y514-T518 PolarHBondContact O-N 3.29Å; Y514-T518 PolarHBondContact O-OG1 2.79Å; F516-T518 VanDerWaalsContact C-N 3.33Å; F516-T518 PolarHBondContact O-N 3.46Å; T518-N520 VanDerWaalsContact CB-ND2 3.31Å; T518-N520 WeakPolarHBondContact CB-ND2 3.35Å; T518-N520 PolarHBondContact O-N 3.47Å; T518-N520 PolarHBondContact O-ND2 3.41Å; T518-N520 WeakPolarHBondContact OG1-CB 3.22Å; T518-N520 PolarHBondContact OG1-N 2.81Å; T518-N520 PolarHBondContact OG1-ND2 2.81Å
519	G	73.3	Confident	67.2	Low	58 Å²	58	89 Å²	89	60%	0.598	48%	0.48	S	S	*	.			trans	67.5	-5.6	-172.8	0	0	0	0	0	114.9	T515 V521	T515-G519 WeakPolarHBondContact O-CA 3.44Å; T515-G519 PolarHBondContact O-N 2.78Å; G519-V521 PolarHBondContact O-N 2.97Å
520	N	71.8	Confident	65	Low	79 Å²	79	100.3 Å²	100.3	42%	0.422	52%	0.522	S	S	.	.			trans	-74	95.8	-175.4	-69.6	-62.1	0	0	0	111.6	Y514 T515 T518 L522	Y514-N520 HydrophobicContact CE1-CB 3.92Å; T515-N520 PolarHBondContact OG1-O 3.1Å; T518-N520 VanDerWaalsContact CB-ND2 3.31Å; T518-N520 WeakPolarHBondContact CB-ND2 3.35Å; T518-N520 PolarHBondContact O-N 3.47Å; T518-N520 PolarHBondContact O-ND2 3.41Å; T518-N520 WeakPolarHBondContact OG1-CB 3.22Å; T518-N520 PolarHBondContact OG1-N 2.81Å; T518-N520 PolarHBondContact OG1-ND2 2.81Å; N520-L522 PolarHBondContact O-N 2.86Å; N520-L522 VanDerWaalsContact O-N 3.12Å
521	V	60.1	Low	63.1	Low	124 Å²	124	110.9 Å²	110.9	75%	0.752	56%	0.562	S	S	*	*			trans	-73.3	95.9	166.8	-175.1	0	0	0	0	108.6	T515 G519	T515-V521 HydrophobicContact CG2-CG2 4.36Å; G519-V521 PolarHBondContact O-N 2.97Å
522	L	61.9	Low	61.8	Low	76 Å²	76	109.2 Å²	109.2	40%	0.398	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-71.2	141.6	168.3	-67.3	173.8	0	0	0	109.4	Y495 L511 Y514 N520 E524	Y495-L522 HydrophobicContact CD1-CD1 4.08Å; Y495-L522 HydrophobicContact CE1-CD1 3.52Å; L511-L522 HydrophobicContact CD1-CD1 3.98Å; Y514-L522 HydrophobicContact CD1-CD1 4.36Å; Y514-L522 HydrophobicContact CE1-CD1 4.18Å; N520-L522 PolarHBondContact O-N 2.86Å; N520-L522 VanDerWaalsContact O-N 3.12Å; L522-E524 PolarHBondContact O-N 3.48Å
523	P	49.9	Very low	60.7	Low	125 Å²	125	109.7 Å²	109.7	81%	0.812	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-61.6	124.7	179.4	25.3	-34	0	0	0	110.4	A525	P523-A525 PolarHBondContact O-N 3.06Å
524	E	49.2	Very low	59.6	Low	182 Å²	182	112 Å²	112	85%	0.85	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-65.3	124.1	-173.5	-65.1	-167.2	129.7	0	0	112.1	L522 K526	L522-E524 PolarHBondContact O-N 3.48Å; E524-K526 VanDerWaalsContact C-N 3.28Å; E524-K526 PolarHBondContact O-N 3.43Å
525	A	42.9	Very low	58.5	Low	105 Å²	105	112.3 Å²	112.3	87%	0.868	58%	0.583	S	S	*	*			trans	-70.4	89.7	164.1	0	0	0	0	0	108.6	P523 E527	P523-A525 PolarHBondContact O-N 3.06Å; A525-E527 PolarHBondContact O-N 3.39Å
526	K	47.2	Very low	57.6	Low	196 Å²	196	112.1 Å²	112.1	85%	0.852	58%	0.578	S	S	*	*	S	Bend	trans	-32	117.9	-177.9	-68.4	-179.2	176.1	-178.6	0	114.2	E524	E524-K526 VanDerWaalsContact C-N 3.28Å; E524-K526 PolarHBondContact O-N 3.43Å
527	E	39.2	Very low	56.6	Low	139 Å²	139	107.7 Å²	107.7	65%	0.65	57%	0.565	S	S	*	*			trans	-160.9	80.1	137.5	-109.7	-167.4	164.1	0	0	109.4	A525 K529	A525-E527 PolarHBondContact O-N 3.39Å; E527-K529 PolarHBondContact O-N 3.03Å; E527-K529 WeakPolarHBondContact OE1-CE 3.46Å; E527-K529 IonicContact OE1-NZ 2.66Å; E527-K529 PolarHBondContact OE1-NZ 2.84Å; E527-K529 WeakPolarHBondContact OE2-CE 3.38Å; E527-K529 IonicContact OE2-NZ 3.4Å; E527-K529 PolarHBondContact OE2-NZ 3.12Å
528	D	39.4	Very low	55.4	Low	166 Å²	166	105.6 Å²	105.6	89%	0.888	55%	0.554	S	S	*	*			trans	-74.6	71.4	168.3	-171.5	19.6	0	0	0	109.7	R530	D528-R530 PolarHBondContact O-N 3.26Å
529	K	44.6	Very low	54.2	Low	128 Å²	128	104.5 Å²	104.5	56%	0.557	55%	0.549	S	S	*	.			trans	-73.8	111.5	172.3	-84.3	172.5	173.4	152.5	0	107.9	E527 R531	E527-K529 PolarHBondContact O-N 3.03Å; E527-K529 WeakPolarHBondContact OE1-CE 3.46Å; E527-K529 IonicContact OE1-NZ 2.66Å; E527-K529 PolarHBondContact OE1-NZ 2.84Å; E527-K529 WeakPolarHBondContact OE2-CE 3.38Å; E527-K529 IonicContact OE2-NZ 3.4Å; E527-K529 PolarHBondContact OE2-NZ 3.12Å; K529-R531 PolarHBondContact O-N 2.64Å; K529-R531 VanDerWaalsContact O-N 3.08Å
530	R	41.1	Very low	53	Low	238 Å²	238	103.5 Å²	103.5	90%	0.898	54%	0.535	S	S	*	.			trans	-44	117.6	169.4	-70	179.9	174.3	-179.3	-3.1	109.4	D528 G532	D528-R530 PolarHBondContact O-N 3.26Å; R530-G532 PolarHBondContact O-N 3.03Å
531	R	47.3	Very low	52	Low	221 Å²	221	102 Å²	102	83%	0.834	53%	0.529	S	S	*	.			trans	-50.6	114.9	-175.7	-59.9	-175.4	-170	-169.6	5	110.2	K529 E535	K529-R531 PolarHBondContact O-N 2.64Å; K529-R531 VanDerWaalsContact O-N 3.08Å; R531-E535 HydrophobicContact CB-CB 4.32Å
532	G	55.4	Low	51.7	Low	36 Å²	36	100.8 Å²	100.8	37%	0.371	52%	0.523	S	S	.	.			trans	-69	161.6	176.5	0	0	0	0	0	111.8	R530 L534 E535	R530-G532 PolarHBondContact O-N 3.03Å; G532-L534 PolarHBondContact O-N 2.9Å; G532-E535 PolarHBondContact N-OE1 2.8Å; G532-E535 WeakPolarHBondContact O-CB 3.35Å; G532-E535 PolarHBondContact O-N 2.9Å
533	I	58.1	Low	51.5	Low	124 Å²	124	103 Å²	103	64%	0.636	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.6	178.7	-165.6	168.7	0	0	0	113.8	Y578	I533-Y578 WeakPolarHBondContact O-CE1 3.46Å; I533-Y578 PolarHBondContact O-OH 3.31Å
534	L	60	Low	52.3	Low	49 Å²	49	102.4 Å²	102.4	26%	0.257	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-11.7	176.6	-61.6	177.2	0	0	0	114.1	G532 K536 R587 A588 S591	G532-L534 PolarHBondContact O-N 2.9Å; L534-K536 PolarHBondContact O-N 3.5Å; L534-R587 HydrophobicContact CB-CG 4.45Å; L534-R587 CarbonylContact O-C 3.52Å; L534-R587 VanDerWaalsContact O-CA 3.31Å; L534-R587 WeakPolarHBondContact O-CA 3.33Å; L534-R587 WeakPolarHBondContact O-CG 3.33Å; L534-A588 HydrophobicContact CD2-CB 4.2Å; L534-A588 PolarHBondContact O-N 2.96Å; L534-S591 WeakPolarHBondContact CD2-OG 3.38Å
535	E	60.3	Low	53.7	Low	57 Å²	57	93.9 Å²	93.9	27%	0.266	48%	0.482	S	S	.	.			trans	-84.4	35.6	-178.5	-63.2	-177.1	-121.7	0	0	112.8	Q468 R531 G532	Q468-E535 PolarHBondContact NE2-OE2 2.81Å; R531-E535 HydrophobicContact CB-CB 4.32Å; G532-E535 PolarHBondContact N-OE1 2.8Å; G532-E535 WeakPolarHBondContact O-CB 3.35Å; G532-E535 PolarHBondContact O-N 2.9Å
536	K	64.6	Low	55.6	Low	36 Å²	36	91.2 Å²	91.2	16%	0.157	45%	0.453	C	S	.	.			trans	-87.6	143.7	167	-161.9	163.6	-175.6	168.5	0	108.9	L534 P570 D572 Y578 Y580 M586	L534-K536 PolarHBondContact O-N 3.5Å; K536-P570 HydrophobicContact CD-CG 4.36Å; K536-D572 WeakPolarHBondContact CE-OD1 3.45Å; K536-D572 VanDerWaalsContact CE-OD2 3.22Å; K536-D572 WeakPolarHBondContact CE-OD2 3.5Å; K536-D572 IonicContact NZ-OD1 3.41Å; K536-D572 PolarHBondContact NZ-OD1 3.14Å; K536-D572 IonicContact NZ-OD2 2.78Å; K536-D572 PolarHBondContact NZ-OD2 2.88Å; K536-Y578 HydrophobicContact CB-CD1 4.46Å; K536-Y578 HydrophobicContact CB-CE1 3.97Å; K536-Y578 HydrophobicContact CD-CD2 4.5Å; K536-Y578 HydrophobicContact CD-CE1 4.32Å; K536-Y578 HydrophobicContact CD-CE2 3.81Å; K536-Y580 WeakPolarHBondContact O-CE1 3.34Å; K536-Y580 PolarHBondContact O-OH 2.94Å; K536-M586 CarbonylContact O-C 3.55Å
537	G	59.2	Low	57.4	Low	22 Å²	22	82.7 Å²	82.7	23%	0.227	42%	0.416	C	S	.	.			trans	-78.2	153.8	172.8	0	0	0	0	0	111.5	S539 Y580	G537-S539 PolarHBondContact O-N 3.48Å; G537-S539 PolarHBondContact O-OG 2.82Å; G537-Y580 PolarHBondContact O-OH 3.49Å; G537-Y580 VanDerWaalsContact O-OH 3.12Å
538	S	55.5	Low	59.7	Low	4 Å²	4	77.6 Å²	77.6	3%	0.028	40%	0.396	C	S	.	.			trans	-71.5	9.2	-175.4	56.9	0	0	0	0	116.8	A540 Y580 P583 Q584 D585	S538-A540 VanDerWaalsContact C-N 3.32Å; S538-A540 PolarHBondContact O-N 2.64Å; S538-Y580 VanDerWaalsContact CA-CZ 3.49Å; S538-P583 WeakPolarHBondContact CB-O 3.4Å; S538-P583 PolarHBondContact OG-O 3.21Å; S538-Q584 WeakPolarHBondContact OG-CA 3.43Å; S538-D585 PolarHBondContact N-O 3.24Å; S538-D585 PolarHBondContact OG-O 3.45Å
539	S	56.9	Low	61.9	Low	30 Å²	30	70.3 Å²	70.3	21%	0.21	36%	0.358	C	S	.	.			trans	30	58.5	173.2	-60.3	0	0	0	0	115.2	G537 T541 S545	G537-S539 PolarHBondContact O-N 3.48Å; G537-S539 PolarHBondContact O-OG 2.82Å; S539-T541 PolarHBondContact O-N 2.92Å; S539-S545 PolarHBondContact O-OG 2.66Å
540	A	48.8	Very low	63.8	Low	36 Å²	36	67 Å²	67	30%	0.298	34%	0.344	S	S	.	.			trans	-73	17	-164	0	0	0	0	0	116.2	S538 P583	S538-A540 VanDerWaalsContact C-N 3.32Å; S538-A540 PolarHBondContact O-N 2.64Å; A540-P583 WeakPolarHBondContact CB-O 3.34Å
541	T	49.8	Very low	66	Low	48 Å²	48	55.8 Å²	55.8	29%	0.294	30%	0.302	S	S	.	.	S	Bend	trans	-106.6	140.1	177.5	51.2	0	0	0	0	111.1	S539 D543 Q544 S545	S539-T541 PolarHBondContact O-N 2.92Å; T541-D543 PolarHBondContact O-N 3.43Å; T541-D543 VanDerWaalsContact O-N 3.14Å; T541-Q544 PolarHBondContact O-N 3.42Å; T541-Q544 WeakPolarHBondContact OG1-CB 3.3Å; T541-Q544 WeakPolarHBondContact OG1-CG 3.48Å; T541-Q544 PolarHBondContact OG1-OE1 2.89Å; T541-S545 PolarHBondContact O-N 3.47Å
542	P	54.4	Low	67.9	Low	98 Å²	98	47.2 Å²	47.2	64%	0.636	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27	176	-24.1	34.8	0	0	0	113.4	Q544	P542-Q544 VanDerWaalsContact C-N 3.33Å; P542-Q544 PolarHBondContact O-N 2.92Å
543	D	58.4	Low	69.2	Low	122 Å²	122	46 Å²	46	65%	0.652	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-23	-174.2	-34.6	-69.8	0	0	0	112.1	T541 R571	T541-D543 PolarHBondContact O-N 3.43Å; T541-D543 VanDerWaalsContact O-N 3.14Å; D543-R571 VanDerWaalsContact O-CD 3.24Å; D543-R571 WeakPolarHBondContact O-CD 3.39Å; D543-R571 PolarHBondContact O-NE 3.23Å
544	Q	66.9	Low	70.2	Confident	114 Å²	114	41.8 Å²	41.8	53%	0.533	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-9.3	-177.7	-65	179.3	-12.1	0	0	113.6	T541 P542 R571	T541-Q544 PolarHBondContact O-N 3.42Å; T541-Q544 WeakPolarHBondContact OG1-CB 3.3Å; T541-Q544 WeakPolarHBondContact OG1-CG 3.48Å; T541-Q544 PolarHBondContact OG1-OE1 2.89Å; P542-Q544 VanDerWaalsContact C-N 3.33Å; P542-Q544 PolarHBondContact O-N 2.92Å; Q544-R571 WeakPolarHBondContact O-CB 3.42Å; Q544-R571 PolarHBondContact O-N 2.86Å
545	S	78.3	Confident	70.6	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	146.2	178.8	-68.9	0	0	0	0	111.7	S539 T541 V568 R571	S539-S545 PolarHBondContact O-OG 2.66Å; T541-S545 PolarHBondContact O-N 3.47Å; S545-V568 WeakPolarHBondContact OG-CG1 3.24Å; S545-R571 PolarHBondContact O-NE 2.94Å; S545-R571 PolarHBondContact O-NH2 3.35Å
546	L	82.2	Confident	70.3	Confident	48 Å²	48	46.4 Å²	46.4	25%	0.251	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-39.7	167.3	-73.4	179	0	0	0	110.8	I569 R571 P574 W643 P645	L546-I569 HydrophobicContact CB-CB 4.42Å; L546-I569 HydrophobicContact CB-CG2 4.19Å; L546-I569 HydrophobicContact CD1-CG2 4.11Å; L546-I569 PolarHBondContact N-O 3.5Å; L546-R571 HydrophobicContact CD2-CG 3.93Å; L546-R571 HydrophobicContact CG-CG 3.93Å; L546-P574 HydrophobicContact CD1-CB 3.54Å; L546-W643 HydrophobicContact CD1-CZ3 3.96Å; L546-W643 HydrophobicContact CD2-CH2 4.29Å; L546-W643 HydrophobicContact CD2-CZ3 3.94Å; L546-P645 HydrophobicContact CD2-CG 4.32Å
547	M	85.8	Confident	70	Confident	17 Å²	17	53.2 Å²	53.2	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	134.3	174.3	-173.7	61.6	177.2	0	0	109.9	V568 I569 L628 R631 W632 A635	M547-V568 WeakPolarHBondContact O-CA 3.24Å; M547-I569 PolarHBondContact O-N 2.92Å; M547-L628 HydrophobicContact CE-CD1 3.65Å; M547-R631 HydrophobicContact CE-CB 3.76Å; M547-R631 HydrophobicContact SD-CB 4.35Å; M547-W632 HydrophobicContact CB-CE3 4.14Å; M547-W632 HydrophobicContact CB-CH2 4.16Å; M547-W632 HydrophobicContact CB-CZ3 3.87Å; M547-W632 HydrophobicContact CE-CD2 3.88Å; M547-W632 HydrophobicContact CE-CG 3.75Å; M547-W632 HydrophobicContact CG-CD2 3.56Å; M547-W632 HydrophobicContact CG-CE3 3.46Å; M547-W632 VanDerWaalsContact CG-CE3 3.46Å; M547-W632 HydrophobicContact CG-CG 4.31Å; M547-W632 HydrophobicContact CG-CH2 3.75Å; M547-W632 HydrophobicContact CG-CZ2 3.83Å; M547-W632 HydrophobicContact CG-CZ3 3.56Å; M547-A635 HydrophobicContact CB-CB 3.8Å; M547-A635 HydrophobicContact CG-CB 4.17Å
548	C	86.8	Confident	70.1	Confident	32 Å²	32	56.2 Å²	56.2	22%	0.216	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	133.1	173.2	61.5	0	0	0	0	112.2	W566 C567 V568	C548-W566 HydrophobicContact CB-CH2 4.36Å; C548-W566 HydrophobicContact CB-CZ2 3.72Å; C548-C567 VanDerWaalsContact CA-O 3.24Å; C548-C567 WeakPolarHBondContact CA-O 3.4Å; C548-V568 HydrophobicContact CB-CG1 4.32Å; C548-V568 HydrophobicContact CB-CG2 4.14Å
549	S	85.3	Confident	70.2	Confident	14 Å²	14	57.8 Å²	57.8	10%	0.098	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	176.4	170.5	82.7	0	0	0	0	111	W566 C567 W632	S549-W566 VanDerWaalsContact CA-CZ3 3.49Å; S549-C567 PolarHBondContact N-O 2.81Å; S549-C567 VanDerWaalsContact N-O 3.1Å; S549-C567 PolarHBondContact O-N 2.74Å; S549-W632 PolarHBondContact OG-NE1 3.37Å
550	F	85.5	Confident	70.3	Confident	59 Å²	59	66.3 Å²	66.3	26%	0.259	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	143.5	159.5	-69.5	-74.6	0	0	0	111.4	G565 W566 P583	F550-G565 WeakPolarHBondContact CA-O 3.44Å; F550-W566 HydrophobicContact CD1-CB 4.3Å; F550-W566 HydrophobicContact CD1-CE3 4.27Å; F550-W566 AromaticContact CD2-CE3 3.92Å; F550-W566 HydrophobicContact CD2-CE3 3.92Å; F550-W566 HydrophobicContact CD2-CZ3 4.15Å; F550-W566 HydrophobicContact CE1-CB 4.15Å; F550-W566 HydrophobicContact CE1-CE3 4.3Å; F550-W566 AromaticContact CE2-CE3 3.95Å; F550-W566 HydrophobicContact CE2-CE3 3.95Å; F550-W566 HydrophobicContact CE2-CZ3 4.22Å; F550-W566 HydrophobicContact CG-CE3 4.09Å; F550-W566 HydrophobicContact CZ-CE3 4.16Å; F550-P583 HydrophobicContact CE1-CG 4.09Å; F550-P583 HydrophobicContact CE2-CG 3.99Å; F550-P583 HydrophobicContact CZ-CG 3.42Å; F550-P583 VanDerWaalsContact CZ-CG 3.42Å
551	L	87.4	Confident	70.8	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.7	164.9	-72.2	176.4	0	0	0	108.6	R564 G565 C567 F610 F621 A623 W632 M636	L551-R564 WeakPolarHBondContact O-CA 3.35Å; L551-G565 PolarHBondContact N-O 3.2Å; L551-G565 PolarHBondContact O-N 2.86Å; L551-C567 HydrophobicContact CD1-CB 3.95Å; L551-C567 HydrophobicContact CG-CB 4.3Å; L551-F610 HydrophobicContact CD1-CZ 3.84Å; L551-F610 HydrophobicContact CD2-CE1 4Å; L551-F610 HydrophobicContact CD2-CZ 4.09Å; L551-F621 HydrophobicContact CB-CD1 4.3Å; L551-F621 HydrophobicContact CD1-CB 4.32Å; L551-F621 HydrophobicContact CD1-CD1 3.89Å; L551-F621 HydrophobicContact CD1-CG 4.29Å; L551-A623 HydrophobicContact CD2-CB 4.06Å; L551-W632 HydrophobicContact CD1-CD2 3.95Å; L551-W632 HydrophobicContact CD1-CG 4.17Å; L551-W632 HydrophobicContact CD1-CZ2 4.12Å; L551-W632 HydrophobicContact CD2-CG 4.32Å; L551-W632 HydrophobicContact CG-CZ2 4.43Å; L551-M636 HydrophobicContact CD1-CE 4.22Å
552	Q	85.7	Confident	71.4	Confident	41 Å²	41	67.3 Å²	67.3	19%	0.192	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.7	169.7	-171.1	175.7	23.4	0	0	109.7	I554 S561 G562 R564 F621 K622	Q552-I554 HydrophobicContact CG-CG1 4.44Å; Q552-S561 PolarHBondContact NE2-OG 2.82Å; Q552-G562 VanDerWaalsContact CG-O 3.24Å; Q552-G562 WeakPolarHBondContact CG-O 3.15Å; Q552-G562 PolarHBondContact NE2-O 3.01Å; Q552-R564 HydrophobicContact CB-CG 4.38Å; Q552-F621 WeakPolarHBondContact O-CA 3.49Å; Q552-K622 HydrophobicContact CB-CB 4.26Å; Q552-K622 PolarHBondContact N-O 3.21Å; Q552-K622 PolarHBondContact O-N 2.85Å
553	L	82.5	Confident	72.2	Confident	11 Å²	11	65.9 Å²	65.9	6%	0.058	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	132.8	177	-74.9	77.2	0	0	0	109.8	G562 P563 V579 F621	L553-G562 CarbonylContact O-C 3.6Å; L553-G562 VanDerWaalsContact O-CA 3.24Å; L553-G562 WeakPolarHBondContact O-CA 3.13Å; L553-P563 PolarHBondContact N-O 3.4Å; L553-V579 HydrophobicContact CD1-CG1 4.07Å; L553-V579 HydrophobicContact CD2-CG1 4.21Å; L553-F621 HydrophobicContact CD1-CD1 4.44Å; L553-F621 HydrophobicContact CD1-CE1 4.37Å; L553-F621 HydrophobicContact CD2-CE1 4.34Å; L553-F621 HydrophobicContact CG-CD1 4.13Å; L553-F621 HydrophobicContact CG-CE1 3.94Å
554	I	79.3	Confident	73.3	Confident	35 Å²	35	67 Å²	67	18%	0.179	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.1	-174.7	-56.4	176.5	0	0	0	108.9	Q552 T620 K622	Q552-I554 HydrophobicContact CG-CG1 4.44Å; I554-T620 HydrophobicContact CB-CG2 4.14Å; I554-T620 HydrophobicContact CG2-CG2 4.49Å; I554-T620 PolarHBondContact N-O 3.29Å; I554-T620 WeakPolarHBondContact O-CB 3.3Å; I554-T620 PolarHBondContact O-N 2.92Å; I554-K622 HydrophobicContact CD1-CB 3.79Å; I554-K622 HydrophobicContact CD1-CD 4.26Å
555	G	68.9	Low	74	Confident	24 Å²	24	61.8 Å²	61.8	25%	0.247	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	149.5	178.5	177.1	0	0	0	0	0	112.3	K557 W558 G559	G555-K557 PolarHBondContact O-N 3.44Å; G555-K557 VanDerWaalsContact O-N 3.09Å; G555-W558 CarbonylContact O-C 3.35Å; G555-W558 PolarHBondContact O-N 3.19Å; G555-G559 PolarHBondContact O-N 3.3Å
556	D	54.8	Low	74.3	Confident	179 Å²	179	63.2 Å²	63.2	96%	0.957	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.6	-168.7	-55.1	-32.5	0	0	0	114.3	W558	D556-W558 VanDerWaalsContact C-N 3.31Å; D556-W558 PolarHBondContact O-N 3.13Å
557	K	57.6	Low	74.7	Confident	179 Å²	179	60.9 Å²	60.9	78%	0.778	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.1	175.3	-63.9	178	-179.4	175.1	0	114.1	G555	G555-K557 PolarHBondContact O-N 3.44Å; G555-K557 VanDerWaalsContact O-N 3.09Å
558	W	61.1	Low	74.8	Confident	85 Å²	85	60.1 Å²	60.1	32%	0.322	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.5	-13.9	-169.9	-60.7	-72.3	0	0	0	114.8	G555 D556 G562	G555-W558 CarbonylContact O-C 3.35Å; G555-W558 PolarHBondContact O-N 3.19Å; D556-W558 VanDerWaalsContact C-N 3.31Å; D556-W558 PolarHBondContact O-N 3.13Å; W558-G562 VanDerWaalsContact O-CA 3.28Å; W558-G562 WeakPolarHBondContact O-CA 3.48Å
559	G	57.8	Low	74.8	Confident	38 Å²	38	58.6 Å²	58.6	39%	0.392	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	77.9	-178.8	-179.3	0	0	0	0	0	114.6	G555 S561	G555-G559 PolarHBondContact O-N 3.3Å; G559-S561 PolarHBondContact O-N 2.88Å
560	K	58.3	Low	74.8	Confident	208 Å²	208	58 Å²	58	90%	0.904	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.4	-175.6	-65.3	-173.2	177.9	-176.6	0	114.7
561	S	59.8	Low	74.5	Confident	98 Å²	98	60.6 Å²	60.6	69%	0.685	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.4	53.7	176	-179.5	0	0	0	0	109.7	Q552 G559	Q552-S561 PolarHBondContact NE2-OG 2.82Å; G559-S561 PolarHBondContact O-N 2.88Å
562	G	62.4	Low	74.1	Confident	7 Å²	7	66.1 Å²	66.1	7%	0.072	33%	0.334	C	S	.	.			trans	-62.6	178.1	-179.6	0	0	0	0	0	114.2	Q552 L553 W558	Q552-G562 VanDerWaalsContact CG-O 3.24Å; Q552-G562 WeakPolarHBondContact CG-O 3.15Å; Q552-G562 PolarHBondContact NE2-O 3.01Å; L553-G562 CarbonylContact O-C 3.6Å; L553-G562 VanDerWaalsContact O-CA 3.24Å; L553-G562 WeakPolarHBondContact O-CA 3.13Å; W558-G562 VanDerWaalsContact O-CA 3.28Å; W558-G562 WeakPolarHBondContact O-CA 3.48Å
563	P	70.3	Confident	74	Confident	68 Å²	68	66 Å²	66	44%	0.442	34%	0.335	S	S	.	.			trans	-68.9	146.2	-169.2	28.6	-33.9	0	0	0	112.4	L553	L553-P563 PolarHBondContact N-O 3.4Å
564	R	81.9	Confident	74.1	Confident	146 Å²	146	66.3 Å²	66.3	55%	0.551	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	119.4	160.5	-73.2	172.8	76	-151.3	6.6	107.9	L551 Q552 E624	L551-R564 WeakPolarHBondContact O-CA 3.35Å; Q552-R564 HydrophobicContact CB-CG 4.38Å; R564-E624 IonicContact CZ-OE1 3.32Å; R564-E624 IonicContact NE-OE1 2.94Å; R564-E624 PolarHBondContact NE-OE1 2.66Å; R564-E624 IonicContact NH2-OE1 2.58Å; R564-E624 PolarHBondContact NH2-OE1 2.57Å
565	G	82.2	Confident	74.5	Confident	5 Å²	5	67.2 Å²	67.2	5%	0.052	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	150.5	169.9	0	0	0	0	0	110.5	F550 L551 Y580	F550-G565 WeakPolarHBondContact CA-O 3.44Å; L551-G565 PolarHBondContact N-O 3.2Å; L551-G565 PolarHBondContact O-N 2.86Å; G565-Y580 CarbonylContact C-O 3.54Å; G565-Y580 WeakPolarHBondContact CA-O 3.47Å
566	W	85.4	Confident	75.4	Confident	32 Å²	32	66.9 Å²	66.9	12%	0.121	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.8	165.9	177	-101.3	0	0	0	108.4	C548 S549 F550 V568 Y580 P583	C548-W566 HydrophobicContact CB-CH2 4.36Å; C548-W566 HydrophobicContact CB-CZ2 3.72Å; S549-W566 VanDerWaalsContact CA-CZ3 3.49Å; F550-W566 HydrophobicContact CD1-CB 4.3Å; F550-W566 HydrophobicContact CD1-CE3 4.27Å; F550-W566 AromaticContact CD2-CE3 3.92Å; F550-W566 HydrophobicContact CD2-CE3 3.92Å; F550-W566 HydrophobicContact CD2-CZ3 4.15Å; F550-W566 HydrophobicContact CE1-CB 4.15Å; F550-W566 HydrophobicContact CE1-CE3 4.3Å; F550-W566 AromaticContact CE2-CE3 3.95Å; F550-W566 HydrophobicContact CE2-CE3 3.95Å; F550-W566 HydrophobicContact CE2-CZ3 4.22Å; F550-W566 HydrophobicContact CG-CE3 4.09Å; F550-W566 HydrophobicContact CZ-CE3 4.16Å; W566-V568 VanDerWaalsContact CD1-CG2 3.4Å; W566-V568 HydrophobicContact CG-CG2 4.45Å; W566-Y580 PolarHBondContact N-O 2.89Å; W566-Y580 PolarHBondContact O-N 2.85Å; W566-P583 HydrophobicContact CB-CG 4.23Å; W566-P583 HydrophobicContact CD2-CB 3.65Å; W566-P583 HydrophobicContact CD2-CG 3.69Å; W566-P583 HydrophobicContact CE3-CB 3.99Å; W566-P583 HydrophobicContact CE3-CG 3.62Å; W566-P583 HydrophobicContact CG-CB 3.92Å; W566-P583 HydrophobicContact CG-CG 3.98Å; W566-P583 HydrophobicContact CZ2-CB 4.25Å; W566-P583 HydrophobicContact CZ3-CB 4.41Å; W566-P583 HydrophobicContact CZ3-CG 4.19Å
567	C	88.9	Confident	77	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.6	-175.7	-69.7	0	0	0	0	110	C548 S549 L551 L577 Y578 W632	C548-C567 VanDerWaalsContact CA-O 3.24Å; C548-C567 WeakPolarHBondContact CA-O 3.4Å; S549-C567 PolarHBondContact N-O 2.81Å; S549-C567 VanDerWaalsContact N-O 3.1Å; S549-C567 PolarHBondContact O-N 2.74Å; L551-C567 HydrophobicContact CD1-CB 3.95Å; L551-C567 HydrophobicContact CG-CB 4.3Å; C567-L577 HydrophobicContact CB-CD1 4.07Å; C567-Y578 CarbonylContact C-O 3.56Å; C567-Y578 WeakPolarHBondContact CA-O 3.24Å; C567-W632 HydrophobicContact CB-CH2 3.72Å; C567-W632 HydrophobicContact CB-CZ2 3.69Å; C567-W632 WeakPolarHBondContact O-CH2 3.09Å; C567-W632 WeakPolarHBondContact O-CZ2 3.28Å
568	V	87.9	Confident	78.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	132.4	-174.6	-173	0	0	0	0	110.5	S545 M547 C548 W566 P570 Y578 Y580	S545-V568 WeakPolarHBondContact OG-CG1 3.24Å; M547-V568 WeakPolarHBondContact O-CA 3.24Å; C548-V568 HydrophobicContact CB-CG1 4.32Å; C548-V568 HydrophobicContact CB-CG2 4.14Å; W566-V568 VanDerWaalsContact CD1-CG2 3.4Å; W566-V568 HydrophobicContact CG-CG2 4.45Å; V568-P570 HydrophobicContact CG1-CG 4.22Å; V568-Y578 PolarHBondContact N-O 2.94Å; V568-Y578 PolarHBondContact O-N 2.83Å; V568-Y580 HydrophobicContact CB-CE2 4.12Å; V568-Y580 HydrophobicContact CG2-CD2 3.95Å; V568-Y580 HydrophobicContact CG2-CE2 3.85Å
569	I	88.3	Confident	79.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	105.5	160.5	-60	168.4	0	0	0	106.5	L546 M547 P574 L577 L594 W632 A635 M636	L546-I569 HydrophobicContact CB-CB 4.42Å; L546-I569 HydrophobicContact CB-CG2 4.19Å; L546-I569 HydrophobicContact CD1-CG2 4.11Å; L546-I569 PolarHBondContact N-O 3.5Å; M547-I569 PolarHBondContact O-N 2.92Å; I569-P574 WeakPolarHBondContact CG2-O 3.22Å; I569-L577 HydrophobicContact CG1-CB 4.44Å; I569-L577 HydrophobicContact CG1-CD1 4Å; I569-L594 HydrophobicContact CD1-CD1 3.58Å; I569-L594 HydrophobicContact CG1-CD1 3.98Å; I569-W632 HydrophobicContact CD1-CE3 4.45Å; I569-W632 HydrophobicContact CD1-CZ3 3.86Å; I569-W632 HydrophobicContact CG1-CZ3 4.04Å; I569-A635 HydrophobicContact CD1-CB 4.39Å; I569-M636 HydrophobicContact CD1-CG 4.05Å
570	P	83.7	Confident	80.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	158.2	179.3	-20.3	33.6	0	0	0	112.8	K536 V568 D572 D573 P574 Y578	K536-P570 HydrophobicContact CD-CG 4.36Å; V568-P570 HydrophobicContact CG1-CG 4.22Å; P570-D572 WeakPolarHBondContact CB-OD1 3.44Å; P570-D573 CarbonylContact O-C 3.58Å; P570-P574 WeakPolarHBondContact O-CA 3.03Å; P570-Y578 HydrophobicContact CG-CD2 3.86Å; P570-Y578 HydrophobicContact CG-CE2 4.13Å
571	R	81.1	Confident	81.6	Confident	115 Å²	115	37 Å²	37	43%	0.434	20%	0.198	S	C	.	.	S	Bend	trans	-78	-29.9	172.8	-73.3	173.5	-176.5	-96.7	-0.4	113.5	D543 Q544 S545 L546 D573	D543-R571 VanDerWaalsContact O-CD 3.24Å; D543-R571 WeakPolarHBondContact O-CD 3.39Å; D543-R571 PolarHBondContact O-NE 3.23Å; Q544-R571 WeakPolarHBondContact O-CB 3.42Å; Q544-R571 PolarHBondContact O-N 2.86Å; S545-R571 PolarHBondContact O-NE 2.94Å; S545-R571 PolarHBondContact O-NH2 3.35Å; L546-R571 HydrophobicContact CD2-CG 3.93Å; L546-R571 HydrophobicContact CG-CG 3.93Å; R571-D573 VanDerWaalsContact C-N 3.31Å
572	D	79.1	Confident	82.1	Confident	116 Å²	116	32.6 Å²	32.6	62%	0.62	17%	0.167	S	C	*	.	S	Bend	trans	-82	-9.7	177.1	71.1	-43.1	0	0	0	113.1	K536 P570	K536-D572 WeakPolarHBondContact CE-OD1 3.45Å; K536-D572 VanDerWaalsContact CE-OD2 3.22Å; K536-D572 WeakPolarHBondContact CE-OD2 3.5Å; K536-D572 IonicContact NZ-OD1 3.41Å; K536-D572 PolarHBondContact NZ-OD1 3.14Å; K536-D572 IonicContact NZ-OD2 2.78Å; K536-D572 PolarHBondContact NZ-OD2 2.88Å; P570-D572 WeakPolarHBondContact CB-OD1 3.44Å
573	D	82.3	Confident	82.3	Confident	40 Å²	40	32.9 Å²	32.9	21%	0.214	17%	0.168	C	C	.	.	S	Bend	trans	-145.1	73.8	170.5	-174	4.2	0	0	0	109.6	P570 R571 L575 V576 Y578	P570-D573 CarbonylContact O-C 3.58Å; R571-D573 VanDerWaalsContact C-N 3.31Å; D573-L575 PolarHBondContact O-N 2.8Å; D573-V576 PolarHBondContact O-N 2.88Å; D573-V576 WeakPolarHBondContact OD1-CG2 3.35Å; D573-V576 WeakPolarHBondContact OD2-CB 3.35Å; D573-V576 WeakPolarHBondContact OD2-CG2 3.42Å; D573-Y578 PolarHBondContact OD2-OH 2.8Å
574	P	85.3	Confident	82.2	Confident	17 Å²	17	32.8 Å²	32.8	11%	0.11	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10	-170.6	31.7	-37.7	0	0	0	113.3	L546 I569 P570 A639	L546-P574 HydrophobicContact CD1-CB 3.54Å; I569-P574 WeakPolarHBondContact CG2-O 3.22Å; P570-P574 WeakPolarHBondContact O-CA 3.03Å; P574-A639 WeakPolarHBondContact O-CB 3.46Å
575	L	87.2	Confident	81.8	Confident	53 Å²	53	25.9 Å²	25.9	28%	0.277	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	1.4	-175	-54.7	-176	0	0	0	113.1	D573 L594 A639	D573-L575 PolarHBondContact O-N 2.8Å; L575-L594 PolarHBondContact O-N 3.37Å; L575-A639 WeakPolarHBondContact CD2-O 3.45Å
576	V	87.4	Confident	81.1	Confident	17 Å²	17	29 Å²	29	10%	0.103	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	125	-177.1	-176.9	0	0	0	0	111.7	D573 Y578	D573-V576 PolarHBondContact O-N 2.88Å; D573-V576 WeakPolarHBondContact OD1-CG2 3.35Å; D573-V576 WeakPolarHBondContact OD2-CB 3.35Å; D573-V576 WeakPolarHBondContact OD2-CG2 3.42Å; V576-Y578 HydrophobicContact CB-CD2 4.26Å; V576-Y578 HydrophobicContact CB-CE2 3.74Å; V576-Y578 HydrophobicContact CG1-CD2 3.85Å; V576-Y578 HydrophobicContact CG1-CE1 4.4Å; V576-Y578 HydrophobicContact CG1-CE2 3.49Å; V576-Y578 VanDerWaalsContact CG1-CE2 3.49Å; V576-Y578 HydrophobicContact CG1-CG 4.46Å
577	L	88.4	Confident	80.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.1	169.2	174.4	64.3	0	0	0	109.8	C567 I569 V579 S591 I592 L594 L612 F621 W632 M636	C567-L577 HydrophobicContact CB-CD1 4.07Å; I569-L577 HydrophobicContact CG1-CB 4.44Å; I569-L577 HydrophobicContact CG1-CD1 4Å; L577-V579 HydrophobicContact CG-CG2 4.41Å; L577-S591 CarbonylContact O-C 3.55Å; L577-S591 WeakPolarHBondContact O-CA 3.36Å; L577-I592 HydrophobicContact CB-CB 4.32Å; L577-I592 HydrophobicContact CD2-CD1 4.29Å; L577-I592 PolarHBondContact N-O 2.83Å; L577-I592 PolarHBondContact O-N 3.1Å; L577-L594 HydrophobicContact CB-CD1 4.01Å; L577-L594 HydrophobicContact CB-CD2 3.82Å; L577-L594 HydrophobicContact CB-CG 3.93Å; L577-L594 HydrophobicContact CD2-CD2 4.32Å; L577-L612 HydrophobicContact CD2-CD1 4.25Å; L577-F621 HydrophobicContact CD2-CE1 4.35Å; L577-F621 HydrophobicContact CD2-CZ 3.9Å; L577-W632 HydrophobicContact CD1-CH2 4.15Å; L577-W632 HydrophobicContact CD1-CZ3 3.99Å; L577-M636 HydrophobicContact CD1-CE 4.12Å; L577-M636 HydrophobicContact CD2-CE 3.62Å; L577-M636 HydrophobicContact CD2-SD 4.45Å
578	Y	86.9	Confident	80.2	Confident	8 Å²	8	32.8 Å²	32.8	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.6	174	-71.7	-91.2	0	0	0	111	I533 K536 C567 V568 P570 D573 V576 Y580 A588	I533-Y578 WeakPolarHBondContact O-CE1 3.46Å; I533-Y578 PolarHBondContact O-OH 3.31Å; K536-Y578 HydrophobicContact CB-CD1 4.46Å; K536-Y578 HydrophobicContact CB-CE1 3.97Å; K536-Y578 HydrophobicContact CD-CD2 4.5Å; K536-Y578 HydrophobicContact CD-CE1 4.32Å; K536-Y578 HydrophobicContact CD-CE2 3.81Å; C567-Y578 CarbonylContact C-O 3.56Å; C567-Y578 WeakPolarHBondContact CA-O 3.24Å; V568-Y578 PolarHBondContact N-O 2.94Å; V568-Y578 PolarHBondContact O-N 2.83Å; P570-Y578 HydrophobicContact CG-CD2 3.86Å; P570-Y578 HydrophobicContact CG-CE2 4.13Å; D573-Y578 PolarHBondContact OD2-OH 2.8Å; V576-Y578 HydrophobicContact CB-CD2 4.26Å; V576-Y578 HydrophobicContact CB-CE2 3.74Å; V576-Y578 HydrophobicContact CG1-CD2 3.85Å; V576-Y578 HydrophobicContact CG1-CE1 4.4Å; V576-Y578 HydrophobicContact CG1-CE2 3.49Å; V576-Y578 VanDerWaalsContact CG1-CE2 3.49Å; V576-Y578 HydrophobicContact CG1-CG 4.46Å; Y578-Y580 VanDerWaalsContact CB-CE2 3.41Å; Y578-Y580 HydrophobicContact CG-CE2 4.44Å; Y578-A588 HydrophobicContact CD1-CB 3.82Å
579	V	85.2	Confident	79.6	Confident	7 Å²	7	39.5 Å²	39.5	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.8	178.9	-172.8	0	0	0	0	109.7	L553 L577 H589 T590	L553-V579 HydrophobicContact CD1-CG1 4.07Å; L553-V579 HydrophobicContact CD2-CG1 4.21Å; L577-V579 HydrophobicContact CG-CG2 4.41Å; V579-H589 WeakPolarHBondContact O-CB 3.43Å; V579-H589 PolarHBondContact O-N 2.86Å; V579-T590 HydrophobicContact CB-CG2 3.87Å; V579-T590 HydrophobicContact CG2-CG2 4.09Å; V579-T590 PolarHBondContact N-O 2.8Å; V579-T590 PolarHBondContact O-N 2.88Å
580	Y	82.2	Confident	79.1	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	157.5	180	-58.1	-92.3	0	0	0	110.7	K536 G537 S538 G565 W566 V568 Y578 A582 D585 R587 A588	K536-Y580 WeakPolarHBondContact O-CE1 3.34Å; K536-Y580 PolarHBondContact O-OH 2.94Å; G537-Y580 PolarHBondContact O-OH 3.49Å; G537-Y580 VanDerWaalsContact O-OH 3.12Å; S538-Y580 VanDerWaalsContact CA-CZ 3.49Å; G565-Y580 CarbonylContact C-O 3.54Å; G565-Y580 WeakPolarHBondContact CA-O 3.47Å; W566-Y580 PolarHBondContact N-O 2.89Å; W566-Y580 PolarHBondContact O-N 2.85Å; V568-Y580 HydrophobicContact CB-CE2 4.12Å; V568-Y580 HydrophobicContact CG2-CD2 3.95Å; V568-Y580 HydrophobicContact CG2-CE2 3.85Å; Y578-Y580 VanDerWaalsContact CB-CE2 3.41Å; Y578-Y580 HydrophobicContact CG-CE2 4.44Å; Y580-A582 WeakPolarHBondContact CB-O 3.35Å; Y580-D585 HydrophobicContact CD1-CB 4.24Å; Y580-D585 WeakPolarHBondContact CD1-O 3.4Å; Y580-R587 WeakPolarHBondContact CD1-O 3.38Å; Y580-A588 HydrophobicContact CD1-CB 4.13Å; Y580-A588 HydrophobicContact CE1-CB 3.78Å
581	A	77.4	Confident	79.1	Confident	47 Å²	47	42.7 Å²	42.7	39%	0.388	22%	0.216	S	C	.	.	S	Bend	trans	-79.8	-27.5	174.8	0	0	0	0	0	112.2	T462	T462-A581 HydrophobicContact CG2-CB 3.56Å
582	A	69.9	Low	79.4	Confident	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.195	C	C	.	.	S	Bend	trans	-147.9	162.9	169.5	0	0	0	0	0	112.9	M460 T462 Y580 Q584 D585	M460-A582 VanDerWaalsContact C-CB 3.42Å; M460-A582 CarbonylContact O-C 3.2Å; M460-A582 WeakPolarHBondContact O-CB 3.4Å; T462-A582 HydrophobicContact CG2-CB 3.89Å; Y580-A582 WeakPolarHBondContact CB-O 3.35Å; A582-Q584 PolarHBondContact O-N 2.88Å; A582-Q584 VanDerWaalsContact O-N 3.08Å; A582-D585 PolarHBondContact N-OD2 3.38Å; A582-D585 PolarHBondContact O-N 3.09Å
583	P	68	Low	79.8	Confident	14 Å²	14	35.3 Å²	35.3	9%	0.091	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9	-167.6	-23.7	35.5	0	0	0	117.5	S538 A540 F550 W566	S538-P583 WeakPolarHBondContact CB-O 3.4Å; S538-P583 PolarHBondContact OG-O 3.21Å; A540-P583 WeakPolarHBondContact CB-O 3.34Å; F550-P583 HydrophobicContact CE1-CG 4.09Å; F550-P583 HydrophobicContact CE2-CG 3.99Å; F550-P583 HydrophobicContact CZ-CG 3.42Å; F550-P583 VanDerWaalsContact CZ-CG 3.42Å; W566-P583 HydrophobicContact CB-CG 4.23Å; W566-P583 HydrophobicContact CD2-CB 3.65Å; W566-P583 HydrophobicContact CD2-CG 3.69Å; W566-P583 HydrophobicContact CE3-CB 3.99Å; W566-P583 HydrophobicContact CE3-CG 3.62Å; W566-P583 HydrophobicContact CG-CB 3.92Å; W566-P583 HydrophobicContact CG-CG 3.98Å; W566-P583 HydrophobicContact CZ2-CB 4.25Å; W566-P583 HydrophobicContact CZ3-CB 4.41Å; W566-P583 HydrophobicContact CZ3-CG 4.19Å
584	Q	67.5	Low	80.1	Confident	66 Å²	66	33.4 Å²	33.4	31%	0.308	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.4	18.2	-179.8	-62.2	-78.1	-13.3	0	0	111.6	V456 M460 V461 M465 S538 A582	V456-Q584 HydrophobicContact CG1-CB 3.93Å; V456-Q584 HydrophobicContact CG1-CG 3.98Å; M460-Q584 HydrophobicContact CB-CB 4.09Å; M460-Q584 HydrophobicContact CB-CG 3.79Å; M460-Q584 HydrophobicContact CG-CG 4.47Å; M460-Q584 WeakPolarHBondContact O-CA 3.45Å; M460-Q584 WeakPolarHBondContact O-CB 3.44Å; M460-Q584 PolarHBondContact O-N 2.8Å; M460-Q584 HydrophobicContact SD-CG 4.35Å; V461-Q584 HydrophobicContact CG1-CB 4.01Å; V461-Q584 WeakPolarHBondContact CG1-O 3.48Å; M465-Q584 HydrophobicContact CE-CB 3.91Å; M465-Q584 WeakPolarHBondContact CE-O 3.5Å; S538-Q584 WeakPolarHBondContact OG-CA 3.43Å; A582-Q584 PolarHBondContact O-N 2.88Å; A582-Q584 VanDerWaalsContact O-N 3.08Å
585	D	73.6	Confident	80.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.			trans	-72.7	130.7	175.6	-77.3	-26	0	0	0	111.2	V461 T462 M463 S538 Y580 A582 R587	V461-D585 WeakPolarHBondContact CA-OD1 3.49Å; T462-D585 PolarHBondContact N-OD1 3.03Å; T462-D585 VanDerWaalsContact OG1-CG 3.32Å; T462-D585 PolarHBondContact OG1-OD1 3.2Å; T462-D585 PolarHBondContact OG1-OD2 3.5Å; M463-D585 HydrophobicContact CE-CB 3.87Å; M463-D585 HydrophobicContact CG-CB 4.22Å; M463-D585 WeakPolarHBondContact CG-OD1 3.41Å; M463-D585 PolarHBondContact N-OD1 2.86Å; M463-D585 HydrophobicContact SD-CB 4.11Å; S538-D585 PolarHBondContact N-O 3.24Å; S538-D585 PolarHBondContact OG-O 3.45Å; Y580-D585 HydrophobicContact CD1-CB 4.24Å; Y580-D585 WeakPolarHBondContact CD1-O 3.4Å; A582-D585 PolarHBondContact N-OD2 3.38Å; A582-D585 PolarHBondContact O-N 3.09Å; D585-R587 PolarHBondContact O-N 3.37Å
586	M	68.3	Low	80.1	Confident	70 Å²	70	37 Å²	37	35%	0.345	21%	0.208	S	C	.	.	S	Bend	trans	-80.9	10.7	-175.1	-63.9	-61	-60	0	0	114.3	M465 K536	M465-M586 HydrophobicContact CB-CG 4.24Å; M465-M586 HydrophobicContact CG-CG 4.44Å; K536-M586 CarbonylContact O-C 3.55Å
587	R	77.5	Confident	80.2	Confident	109 Å²	109	36.7 Å²	36.7	41%	0.411	21%	0.205	S	C	.	.	S	Bend	trans	-158.7	135.2	179.9	162.8	170.9	164.1	-173.6	-4	109.7	M463 L534 Y580 D585	M463-R587 HydrophobicContact CE-CB 4.46Å; M463-R587 WeakPolarHBondContact CE-O 3.24Å; M463-R587 HydrophobicContact SD-CB 3.96Å; L534-R587 HydrophobicContact CB-CG 4.45Å; L534-R587 CarbonylContact O-C 3.52Å; L534-R587 VanDerWaalsContact O-CA 3.31Å; L534-R587 WeakPolarHBondContact O-CA 3.33Å; L534-R587 WeakPolarHBondContact O-CG 3.33Å; Y580-R587 WeakPolarHBondContact CD1-O 3.38Å; D585-R587 PolarHBondContact O-N 3.37Å
588	A	77.7	Confident	80.2	Confident	3 Å²	3	43.1 Å²	43.1	3%	0.025	24%	0.236	C	C	.	.			trans	-73.1	148.1	176.6	0	0	0	0	0	111.9	L534 Y578 Y580	L534-A588 HydrophobicContact CD2-CB 4.2Å; L534-A588 PolarHBondContact O-N 2.96Å; Y578-A588 HydrophobicContact CD1-CB 3.82Å; Y580-A588 HydrophobicContact CD1-CB 4.13Å; Y580-A588 HydrophobicContact CE1-CB 3.78Å
589	H	74.9	Confident	80.4	Confident	141 Å²	141	44 Å²	44	65%	0.653	24%	0.241	S	C	*	.	S	Bend	trans	-73.2	-37.2	167.5	-178.5	-59.8	0	0	0	110.5	V579	V579-H589 WeakPolarHBondContact O-CB 3.43Å; V579-H589 PolarHBondContact O-N 2.86Å
590	T	77.8	Confident	80.7	Confident	43 Å²	43	45.7 Å²	45.7	26%	0.264	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	154.6	173.3	-170.2	0	0	0	0	110.5	V579	V579-T590 HydrophobicContact CB-CG2 3.87Å; V579-T590 HydrophobicContact CG2-CG2 4.09Å; V579-T590 PolarHBondContact N-O 2.8Å; V579-T590 PolarHBondContact O-N 2.88Å
591	S	84.1	Confident	80.9	Confident	26 Å²	26	50.3 Å²	50.3	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	147.4	167.1	53.1	0	0	0	0	109.3	L534 L577	L534-S591 WeakPolarHBondContact CD2-OG 3.38Å; L577-S591 CarbonylContact O-C 3.55Å; L577-S591 WeakPolarHBondContact O-CA 3.36Å
592	I	86.7	Confident	81	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	111.4	174.4	-59.7	169.1	0	0	0	106.7	L577 L594 Y597 Y619 F621	L577-I592 HydrophobicContact CB-CB 4.32Å; L577-I592 HydrophobicContact CD2-CD1 4.29Å; L577-I592 PolarHBondContact N-O 2.83Å; L577-I592 PolarHBondContact O-N 3.1Å; I592-L594 HydrophobicContact CG2-CD2 4.45Å; I592-L594 PolarHBondContact O-N 2.87Å; I592-Y597 HydrophobicContact CG2-CE2 4.31Å; I592-Y619 HydrophobicContact CD1-CD1 3.61Å; I592-Y619 HydrophobicContact CD1-CD2 4.17Å; I592-Y619 HydrophobicContact CD1-CE1 3.57Å; I592-Y619 HydrophobicContact CD1-CE2 4.15Å; I592-Y619 HydrophobicContact CD1-CG 3.91Å; I592-Y619 HydrophobicContact CG1-CE1 4.06Å; I592-Y619 HydrophobicContact CG1-CE2 4.38Å; I592-Y619 HydrophobicContact CG2-CE2 4.14Å; I592-F621 HydrophobicContact CD1-CZ 4.1Å
593	P	87.6	Confident	81.3	Confident	75 Å²	75	52.4 Å²	52.4	49%	0.487	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	123.2	172.2	29.1	-32.2	0	0	0	108.3	Y597	P593-Y597 WeakPolarHBondContact O-CD2 3.03Å; P593-Y597 WeakPolarHBondContact O-CE2 3.43Å
594	L	88.4	Confident	81	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.332	C	S	.	.			trans	-84.3	-21.1	-173.4	-65.4	178.4	0	0	0	113.2	I569 L575 L577 I592 G596 Y597 L612 M636 A639 A640	I569-L594 HydrophobicContact CD1-CD1 3.58Å; I569-L594 HydrophobicContact CG1-CD1 3.98Å; L575-L594 PolarHBondContact O-N 3.37Å; L577-L594 HydrophobicContact CB-CD1 4.01Å; L577-L594 HydrophobicContact CB-CD2 3.82Å; L577-L594 HydrophobicContact CB-CG 3.93Å; L577-L594 HydrophobicContact CD2-CD2 4.32Å; I592-L594 HydrophobicContact CG2-CD2 4.45Å; I592-L594 PolarHBondContact O-N 2.87Å; L594-G596 PolarHBondContact O-N 3.02Å; L594-G596 VanDerWaalsContact O-N 3.14Å; L594-Y597 WeakPolarHBondContact O-CB 3.49Å; L594-Y597 PolarHBondContact O-N 3.44Å; L594-L612 HydrophobicContact CD2-CD1 3.58Å; L594-M636 HydrophobicContact CD1-CG 4.26Å; L594-A639 HydrophobicContact CB-CB 3.97Å; L594-A639 HydrophobicContact CD1-CB 3.47Å; L594-A639 VanDerWaalsContact CD1-CB 3.47Å; L594-A639 HydrophobicContact CG-CB 4.38Å; L594-A640 VanDerWaalsContact O-CA 3.23Å; L594-A640 WeakPolarHBondContact O-CA 3.45Å; L594-A640 WeakPolarHBondContact O-CB 3.38Å
595	L	87.9	Confident	81	Confident	97 Å²	97	62 Å²	62	51%	0.508	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	118.9	-175.2	-173.1	66.7	0	0	0	111.8	Q614	L595-Q614 PolarHBondContact O-NE2 2.94Å
596	G	84.3	Confident	81.4	Confident	48 Å²	48	63.7 Å²	63.7	50%	0.495	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	13.6	-178.6	0	0	0	0	0	116	L594 Q614 A640	L594-G596 PolarHBondContact O-N 3.02Å; L594-G596 VanDerWaalsContact O-N 3.14Å; G596-Q614 PolarHBondContact O-NE2 3.5Å; G596-A640 PolarHBondContact N-O 2.79Å
597	Y	90.1	Very high	82.2	Confident	11 Å²	11	63.7 Å²	63.7	4%	0.043	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-76.3	142.7	167.8	-88.2	-103.1	0	0	0	111.3	I592 P593 L594 L612 Q614 Y619 A640	I592-Y597 HydrophobicContact CG2-CE2 4.31Å; P593-Y597 WeakPolarHBondContact O-CD2 3.03Å; P593-Y597 WeakPolarHBondContact O-CE2 3.43Å; L594-Y597 WeakPolarHBondContact O-CB 3.49Å; L594-Y597 PolarHBondContact O-N 3.44Å; Y597-L612 HydrophobicContact CD1-CB 3.79Å; Y597-L612 HydrophobicContact CE1-CB 4.33Å; Y597-Q614 HydrophobicContact CD1-CB 3.56Å; Y597-Q614 HydrophobicContact CD2-CB 3.8Å; Y597-Q614 HydrophobicContact CD2-CG 4.32Å; Y597-Q614 HydrophobicContact CE1-CB 3.54Å; Y597-Q614 HydrophobicContact CE2-CB 3.74Å; Y597-Q614 HydrophobicContact CE2-CG 4.29Å; Y597-Q614 HydrophobicContact CG-CB 3.72Å; Y597-Y619 HydrophobicContact CE1-CD2 4.11Å; Y597-Y619 HydrophobicContact CE1-CE2 4.1Å; Y597-A640 VanDerWaalsContact O-CB 3.26Å; Y597-A640 WeakPolarHBondContact O-CB 3.42Å
598	Q	88.8	Confident	82.7	Confident	136 Å²	136	62.6 Å²	62.6	64%	0.636	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	127.7	167.5	-66.1	-177.7	-7.9	0	0	109.1	L612 Q613	Q598-L612 WeakPolarHBondContact O-CA 3.17Å; Q598-Q613 PolarHBondContact N-O 3.34Å; Q598-Q613 PolarHBondContact O-N 3.03Å
599	V	91.4	Very high	83.3	Confident	25 Å²	25	63.1 Å²	63.1	15%	0.152	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.9	175.1	-166.1	0	0	0	0	108.2	Q611 L612 M633 M636 E637	V599-Q611 WeakPolarHBondContact CA-O 3.3Å; V599-L612 HydrophobicContact CB-CD2 4.21Å; V599-L612 HydrophobicContact CG1-CD2 4.1Å; V599-L612 HydrophobicContact CG2-CD2 3.65Å; V599-M633 HydrophobicContact CG1-CB 4.04Å; V599-M633 HydrophobicContact CG1-CE 4.1Å; V599-M633 HydrophobicContact CG1-CG 3.95Å; V599-M636 HydrophobicContact CG2-CB 3.97Å; V599-E637 HydrophobicContact CB-CG 3.7Å; V599-E637 HydrophobicContact CG1-CG 4.3Å; V599-E637 HydrophobicContact CG2-CB 4.43Å; V599-E637 HydrophobicContact CG2-CG 3.62Å
600	T	90.4	Very high	84.1	Confident	44 Å²	44	56.4 Å²	56.4	27%	0.27	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.4	-175	56.5	0	0	0	0	112.1	F610 Q611	T600-F610 CarbonylContact O-C 3.58Å; T600-F610 WeakPolarHBondContact O-CA 3.36Å; T600-F610 WeakPolarHBondContact O-CB 3.16Å; T600-Q611 PolarHBondContact N-O 3.15Å; T600-Q611 PolarHBondContact O-N 2.92Å; T600-Q611 WeakPolarHBondContact OG1-CB 2.98Å
601	V	87.2	Confident	84.8	Confident	97 Å²	97	55.9 Å²	55.9	59%	0.588	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.2	171.3	174.5	0	0	0	0	108.9	M633	V601-M633 HydrophobicContact CG2-CE 4.01Å
602	G	80	Confident	85	Confident	11 Å²	11	54.7 Å²	54.7	11%	0.113	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-65.7	167.1	179.9	0	0	0	0	0	113.7	V609	G602-V609 PolarHBondContact N-O 2.77Å
603	P	74.7	Confident	85.1	Confident	85 Å²	85	59 Å²	59	55%	0.552	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-58.5	145.2	-178.9	24.1	-34.4	0	0	0	112.5	G605	P603-G605 PolarHBondContact O-N 3.22Å; P603-G605 VanDerWaalsContact O-N 3.11Å
604	Q	61.5	Low	85	Confident	202 Å²	202	57.9 Å²	57.9	94%	0.944	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	112.8	178.9	-71	-79.1	-9.7	0	0	111.5
605	G	68.1	Low	84.7	Confident	80 Å²	80	63.6 Å²	63.6	83%	0.825	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	158.9	-35.2	175.8	0	0	0	0	0	116.4	P603	P603-G605 PolarHBondContact O-N 3.22Å; P603-G605 VanDerWaalsContact O-N 3.11Å
606	D	81.3	Confident	84.1	Confident	34 Å²	34	62.7 Å²	62.7	18%	0.182	39%	0.387	C	S	.	.			trans	-139.5	115.2	173.6	-174.3	-35.1	0	0	0	109.8	R608 V609 K622	D606-R608 PolarHBondContact O-N 3.17Å; D606-R608 VanDerWaalsContact O-N 3.08Å; D606-R608 WeakPolarHBondContact OD1-CB 3.42Å; D606-R608 IonicContact OD1-CZ 3.67Å; D606-R608 PolarHBondContact OD1-N 2.91Å; D606-R608 VanDerWaalsContact OD1-N 3.08Å; D606-R608 IonicContact OD1-NE 2.96Å; D606-R608 PolarHBondContact OD1-NE 2.89Å; D606-R608 IonicContact OD1-NH2 2.72Å; D606-R608 PolarHBondContact OD1-NH2 2.67Å; D606-R608 IonicContact OD2-CZ 3.38Å; D606-R608 IonicContact OD2-NE 3.48Å; D606-R608 IonicContact OD2-NH2 3.19Å; D606-R608 PolarHBondContact OD2-NH2 2.78Å; D606-V609 HydrophobicContact CB-CG2 3.82Å; D606-V609 WeakPolarHBondContact O-CG2 3.23Å; D606-V609 PolarHBondContact O-N 3.41Å; D606-V609 VanDerWaalsContact O-N 3.15Å; D606-K622 VanDerWaalsContact OD2-CE 3.3Å; D606-K622 WeakPolarHBondContact OD2-CE 3.48Å; D606-K622 IonicContact OD2-NZ 3.07Å; D606-K622 PolarHBondContact OD2-NZ 3.07Å
607	P	85.4	Confident	84	Confident	71 Å²	71	64.7 Å²	64.7	46%	0.461	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.7	-170.7	27.9	-36.1	0	0	0	113.4	V609 E626 K629	P607-V609 VanDerWaalsContact C-N 3.29Å; P607-V609 PolarHBondContact O-N 3.35Å; P607-E626 HydrophobicContact CB-CG 4.12Å; P607-E626 WeakPolarHBondContact CB-OE1 3.28Å; P607-E626 HydrophobicContact CG-CG 4.2Å; P607-E626 WeakPolarHBondContact CG-OE1 3.5Å; P607-K629 WeakPolarHBondContact O-CD 3.12Å; P607-K629 WeakPolarHBondContact O-CE 3.42Å; P607-K629 PolarHBondContact O-NZ 2.56Å
608	R	88.9	Confident	83.8	Confident	85 Å²	85	68.5 Å²	68.5	32%	0.321	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.8	178.1	-57.6	165.6	-68.9	-164.4	-5.6	114	D606 K622 A623 E624 E626	D606-R608 PolarHBondContact O-N 3.17Å; D606-R608 VanDerWaalsContact O-N 3.08Å; D606-R608 WeakPolarHBondContact OD1-CB 3.42Å; D606-R608 IonicContact OD1-CZ 3.67Å; D606-R608 PolarHBondContact OD1-N 2.91Å; D606-R608 VanDerWaalsContact OD1-N 3.08Å; D606-R608 IonicContact OD1-NE 2.96Å; D606-R608 PolarHBondContact OD1-NE 2.89Å; D606-R608 IonicContact OD1-NH2 2.72Å; D606-R608 PolarHBondContact OD1-NH2 2.67Å; D606-R608 IonicContact OD2-CZ 3.38Å; D606-R608 IonicContact OD2-NE 3.48Å; D606-R608 IonicContact OD2-NH2 3.19Å; D606-R608 PolarHBondContact OD2-NH2 2.78Å; R608-K622 HydrophobicContact CB-CG 4.4Å; R608-A623 WeakPolarHBondContact CB-O 3.41Å; R608-A623 PolarHBondContact O-N 3.34Å; R608-E624 VanDerWaalsContact CD-O 3.23Å; R608-E624 WeakPolarHBondContact CD-O 3.48Å; R608-E626 HydrophobicContact CG-CG 3.99Å
609	V	89.4	Confident	83.7	Confident	14 Å²	14	63.9 Å²	63.9	9%	0.085	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	139.2	-178	-173.4	0	0	0	0	111.2	G602 D606 P607 T620 F621 K622 K629	G602-V609 PolarHBondContact N-O 2.77Å; D606-V609 HydrophobicContact CB-CG2 3.82Å; D606-V609 WeakPolarHBondContact O-CG2 3.23Å; D606-V609 PolarHBondContact O-N 3.41Å; D606-V609 VanDerWaalsContact O-N 3.15Å; P607-V609 VanDerWaalsContact C-N 3.29Å; P607-V609 PolarHBondContact O-N 3.35Å; V609-T620 HydrophobicContact CG1-CG2 3.46Å; V609-T620 VanDerWaalsContact CG1-CG2 3.46Å; V609-F621 WeakPolarHBondContact CA-O 3.36Å; V609-K622 HydrophobicContact CG2-CB 4.17Å; V609-K622 HydrophobicContact CG2-CD 4.23Å; V609-K622 HydrophobicContact CG2-CG 4.26Å; V609-K629 WeakPolarHBondContact O-CE 3.49Å; V609-K629 PolarHBondContact O-NZ 3.33Å
610	F	92.4	Very high	83.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	164.8	174.2	65.8	-82.6	0	0	0	110.2	L551 T600 F621 A623 K629 W632 M633 M636	L551-F610 HydrophobicContact CD1-CZ 3.84Å; L551-F610 HydrophobicContact CD2-CE1 4Å; L551-F610 HydrophobicContact CD2-CZ 4.09Å; T600-F610 CarbonylContact O-C 3.58Å; T600-F610 WeakPolarHBondContact O-CA 3.36Å; T600-F610 WeakPolarHBondContact O-CB 3.16Å; F610-F621 HydrophobicContact CD1-CB 4.14Å; F610-F621 HydrophobicContact CD2-CB 4.19Å; F610-F621 HydrophobicContact CD2-CD2 4.39Å; F610-F621 HydrophobicContact CE1-CB 3.68Å; F610-F621 HydrophobicContact CE2-CB 3.72Å; F610-F621 AromaticContact CE2-CD2 3.94Å; F610-F621 HydrophobicContact CE2-CD2 3.94Å; F610-F621 HydrophobicContact CE2-CG 4.05Å; F610-F621 HydrophobicContact CG-CB 4.39Å; F610-F621 HydrophobicContact CZ-CB 3.45Å; F610-F621 VanDerWaalsContact CZ-CB 3.45Å; F610-F621 HydrophobicContact CZ-CD2 4.43Å; F610-F621 HydrophobicContact CZ-CG 4.08Å; F610-F621 PolarHBondContact N-O 3.06Å; F610-F621 PolarHBondContact O-N 2.85Å; F610-F621 VanDerWaalsContact O-O 3.09Å; F610-A623 HydrophobicContact CE1-CB 4.46Å; F610-K629 HydrophobicContact CB-CD 4.33Å; F610-K629 HydrophobicContact CB-CG 4.33Å; F610-K629 HydrophobicContact CD1-CB 4.2Å; F610-K629 HydrophobicContact CD1-CD 4.3Å; F610-K629 HydrophobicContact CD1-CG 3.83Å; F610-K629 HydrophobicContact CG-CG 4.37Å; F610-W632 HydrophobicContact CE1-CB 4.19Å; F610-W632 HydrophobicContact CE2-CB 4.27Å; F610-W632 HydrophobicContact CZ-CB 3.69Å; F610-W632 HydrophobicContact CZ-CG 4.17Å; F610-M633 HydrophobicContact CB-CG 3.82Å; F610-M633 HydrophobicContact CB-SD 3.72Å; F610-M633 HydrophobicContact CD2-CG 3.98Å; F610-M633 HydrophobicContact CG-CG 3.9Å; F610-M633 HydrophobicContact CG-SD 4.42Å; F610-M636 HydrophobicContact CE2-CE 3.98Å; F610-M636 HydrophobicContact CE2-SD 3.77Å; F610-M636 HydrophobicContact CZ-CE 4.29Å
611	Q	91.4	Very high	83.5	Confident	33 Å²	33	61.6 Å²	61.6	15%	0.154	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.2	-173.6	-70	-178.4	-46.5	0	0	111.8	V599 T600 L618 Y619 T620	V599-Q611 WeakPolarHBondContact CA-O 3.3Å; T600-Q611 PolarHBondContact N-O 3.15Å; T600-Q611 PolarHBondContact O-N 2.92Å; T600-Q611 WeakPolarHBondContact OG1-CB 2.98Å; Q611-L618 HydrophobicContact CB-CD1 4.03Å; Q611-L618 HydrophobicContact CG-CD1 4.33Å; Q611-Y619 CarbonylContact C-O 3.56Å; Q611-Y619 VanDerWaalsContact CA-O 3.28Å; Q611-Y619 WeakPolarHBondContact CA-O 3.37Å; Q611-T620 HydrophobicContact CG-CG2 3.88Å; Q611-T620 PolarHBondContact NE2-OG1 2.9Å
612	L	90.1	Very high	83.6	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.9	166.5	-68.9	-174	0	0	0	108.8	L577 L594 Y597 Q598 V599 L618 Y619 F621 M636	L577-L612 HydrophobicContact CD2-CD1 4.25Å; L594-L612 HydrophobicContact CD2-CD1 3.58Å; Y597-L612 HydrophobicContact CD1-CB 3.79Å; Y597-L612 HydrophobicContact CE1-CB 4.33Å; Q598-L612 WeakPolarHBondContact O-CA 3.17Å; V599-L612 HydrophobicContact CB-CD2 4.21Å; V599-L612 HydrophobicContact CG1-CD2 4.1Å; V599-L612 HydrophobicContact CG2-CD2 3.65Å; L612-L618 WeakPolarHBondContact O-CA 3.39Å; L612-Y619 PolarHBondContact N-O 3.47Å; L612-Y619 PolarHBondContact O-N 2.94Å; L612-F621 HydrophobicContact CB-CE2 4.28Å; L612-F621 HydrophobicContact CD1-CE2 3.75Å; L612-F621 HydrophobicContact CD1-CZ 4.34Å; L612-F621 HydrophobicContact CG-CD2 4.37Å; L612-F621 HydrophobicContact CG-CE2 3.82Å; L612-M636 HydrophobicContact CD1-SD 3.75Å; L612-M636 HydrophobicContact CD2-CB 4.19Å; L612-M636 HydrophobicContact CD2-SD 3.77Å; L612-M636 HydrophobicContact CG-SD 3.93Å
613	Q	88.1	Confident	84.1	Confident	90 Å²	90	58.8 Å²	58.8	42%	0.421	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130	-179.1	-170.5	174.5	2	0	0	112.1	Q598 Q617 L618	Q598-Q613 PolarHBondContact N-O 3.34Å; Q598-Q613 PolarHBondContact O-N 3.03Å; Q613-Q617 WeakPolarHBondContact CA-O 3.46Å; Q613-L618 HydrophobicContact CB-CD1 4.11Å; Q613-L618 HydrophobicContact CG-CD1 4.36Å
614	Q	86.4	Confident	84.6	Confident	51 Å²	51	59.3 Å²	59.3	24%	0.238	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	128.4	170.7	-173.1	-176.6	71.7	0	0	110.3	L595 G596 Y597 G616 Q617	L595-Q614 PolarHBondContact O-NE2 2.94Å; G596-Q614 PolarHBondContact O-NE2 3.5Å; Y597-Q614 HydrophobicContact CD1-CB 3.56Å; Y597-Q614 HydrophobicContact CD2-CB 3.8Å; Y597-Q614 HydrophobicContact CD2-CG 4.32Å; Y597-Q614 HydrophobicContact CE1-CB 3.54Å; Y597-Q614 HydrophobicContact CE2-CB 3.74Å; Y597-Q614 HydrophobicContact CE2-CG 4.29Å; Y597-Q614 HydrophobicContact CG-CB 3.72Å; Q614-G616 VanDerWaalsContact C-N 3.26Å; Q614-G616 PolarHBondContact O-N 3.34Å; Q614-Q617 PolarHBondContact N-O 3.03Å; Q614-Q617 WeakPolarHBondContact O-CA 3.21Å; Q614-Q617 WeakPolarHBondContact O-CB 3.32Å; Q614-Q617 PolarHBondContact O-N 2.82Å
615	S	80.9	Confident	85.7	Confident	121 Å²	121	52.7 Å²	52.7	85%	0.846	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	42.1	168	-56.7	0	0	0	0	115.4	Q617	S615-Q617 VanDerWaalsContact C-N 3.34Å; S615-Q617 PolarHBondContact O-N 3.04Å
616	G	76.4	Confident	86.6	Confident	77 Å²	77	54.2 Å²	54.2	79%	0.794	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	-9.3	-179	0	0	0	0	0	115.6	Q614	Q614-G616 VanDerWaalsContact C-N 3.26Å; Q614-G616 PolarHBondContact O-N 3.34Å
617	Q	80.8	Confident	86.8	Confident	91 Å²	91	58.8 Å²	58.8	43%	0.425	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	135.1	167.3	-59.2	-175.1	80.4	0	0	109.8	Q613 Q614 S615 Y619	Q613-Q617 WeakPolarHBondContact CA-O 3.46Å; Q614-Q617 PolarHBondContact N-O 3.03Å; Q614-Q617 WeakPolarHBondContact O-CA 3.21Å; Q614-Q617 WeakPolarHBondContact O-CB 3.32Å; Q614-Q617 PolarHBondContact O-N 2.82Å; S615-Q617 VanDerWaalsContact C-N 3.34Å; S615-Q617 PolarHBondContact O-N 3.04Å; Q617-Y619 HydrophobicContact CB-CE2 4.19Å; Q617-Y619 PolarHBondContact OE1-OH 2.89Å
618	L	85.9	Confident	86.9	Confident	91 Å²	91	56.1 Å²	56.1	48%	0.476	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	122.8	177.6	-179.6	66	0	0	0	109.4	Q611 L612 Q613	Q611-L618 HydrophobicContact CB-CD1 4.03Å; Q611-L618 HydrophobicContact CG-CD1 4.33Å; L612-L618 WeakPolarHBondContact O-CA 3.39Å; Q613-L618 HydrophobicContact CB-CD1 4.11Å; Q613-L618 HydrophobicContact CG-CD1 4.36Å
619	Y	86.9	Confident	87	Confident	39 Å²	39	53.1 Å²	53.1	15%	0.153	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126	172.8	-59.3	-93.2	0	0	0	108.7	I592 Y597 Q611 L612 Q617	I592-Y619 HydrophobicContact CD1-CD1 3.61Å; I592-Y619 HydrophobicContact CD1-CD2 4.17Å; I592-Y619 HydrophobicContact CD1-CE1 3.57Å; I592-Y619 HydrophobicContact CD1-CE2 4.15Å; I592-Y619 HydrophobicContact CD1-CG 3.91Å; I592-Y619 HydrophobicContact CG1-CE1 4.06Å; I592-Y619 HydrophobicContact CG1-CE2 4.38Å; I592-Y619 HydrophobicContact CG2-CE2 4.14Å; Y597-Y619 HydrophobicContact CE1-CD2 4.11Å; Y597-Y619 HydrophobicContact CE1-CE2 4.1Å; Q611-Y619 CarbonylContact C-O 3.56Å; Q611-Y619 VanDerWaalsContact CA-O 3.28Å; Q611-Y619 WeakPolarHBondContact CA-O 3.37Å; L612-Y619 PolarHBondContact N-O 3.47Å; L612-Y619 PolarHBondContact O-N 2.94Å; Q617-Y619 HydrophobicContact CB-CE2 4.19Å; Q617-Y619 PolarHBondContact OE1-OH 2.89Å
620	T	88.8	Confident	86.9	Confident	19 Å²	19	54.4 Å²	54.4	12%	0.117	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.9	174.9	-52	0	0	0	0	109.5	I554 V609 Q611	I554-T620 HydrophobicContact CB-CG2 4.14Å; I554-T620 HydrophobicContact CG2-CG2 4.49Å; I554-T620 PolarHBondContact N-O 3.29Å; I554-T620 WeakPolarHBondContact O-CB 3.3Å; I554-T620 PolarHBondContact O-N 2.92Å; V609-T620 HydrophobicContact CG1-CG2 3.46Å; V609-T620 VanDerWaalsContact CG1-CG2 3.46Å; Q611-T620 HydrophobicContact CG-CG2 3.88Å; Q611-T620 PolarHBondContact NE2-OG1 2.9Å
621	F	89.7	Confident	86.8	Confident	1 Å²	1	61.2 Å²	61.2	0%	0.004	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.7	179.1	-61.2	-86.1	0	0	0	110.1	L551 Q552 L553 L577 I592 V609 F610 L612	L551-F621 HydrophobicContact CB-CD1 4.3Å; L551-F621 HydrophobicContact CD1-CB 4.32Å; L551-F621 HydrophobicContact CD1-CD1 3.89Å; L551-F621 HydrophobicContact CD1-CG 4.29Å; Q552-F621 WeakPolarHBondContact O-CA 3.49Å; L553-F621 HydrophobicContact CD1-CD1 4.44Å; L553-F621 HydrophobicContact CD1-CE1 4.37Å; L553-F621 HydrophobicContact CD2-CE1 4.34Å; L553-F621 HydrophobicContact CG-CD1 4.13Å; L553-F621 HydrophobicContact CG-CE1 3.94Å; L577-F621 HydrophobicContact CD2-CE1 4.35Å; L577-F621 HydrophobicContact CD2-CZ 3.9Å; I592-F621 HydrophobicContact CD1-CZ 4.1Å; V609-F621 WeakPolarHBondContact CA-O 3.36Å; F610-F621 HydrophobicContact CD1-CB 4.14Å; F610-F621 HydrophobicContact CD2-CB 4.19Å; F610-F621 HydrophobicContact CD2-CD2 4.39Å; F610-F621 HydrophobicContact CE1-CB 3.68Å; F610-F621 HydrophobicContact CE2-CB 3.72Å; F610-F621 AromaticContact CE2-CD2 3.94Å; F610-F621 HydrophobicContact CE2-CD2 3.94Å; F610-F621 HydrophobicContact CE2-CG 4.05Å; F610-F621 HydrophobicContact CG-CB 4.39Å; F610-F621 HydrophobicContact CZ-CB 3.45Å; F610-F621 VanDerWaalsContact CZ-CB 3.45Å; F610-F621 HydrophobicContact CZ-CD2 4.43Å; F610-F621 HydrophobicContact CZ-CG 4.08Å; F610-F621 PolarHBondContact N-O 3.06Å; F610-F621 PolarHBondContact O-N 2.85Å; F610-F621 VanDerWaalsContact O-O 3.09Å; L612-F621 HydrophobicContact CB-CE2 4.28Å; L612-F621 HydrophobicContact CD1-CE2 3.75Å; L612-F621 HydrophobicContact CD1-CZ 4.34Å; L612-F621 HydrophobicContact CG-CD2 4.37Å; L612-F621 HydrophobicContact CG-CE2 3.82Å
622	K	89.3	Confident	86.9	Confident	48 Å²	48	59.6 Å²	59.6	21%	0.209	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.8	170.9	172.8	169.2	169.9	166.9	0	109.9	Q552 I554 D606 R608 V609	Q552-K622 HydrophobicContact CB-CB 4.26Å; Q552-K622 PolarHBondContact N-O 3.21Å; Q552-K622 PolarHBondContact O-N 2.85Å; I554-K622 HydrophobicContact CD1-CB 3.79Å; I554-K622 HydrophobicContact CD1-CD 4.26Å; D606-K622 VanDerWaalsContact OD2-CE 3.3Å; D606-K622 WeakPolarHBondContact OD2-CE 3.48Å; D606-K622 IonicContact OD2-NZ 3.07Å; D606-K622 PolarHBondContact OD2-NZ 3.07Å; R608-K622 HydrophobicContact CB-CG 4.4Å; V609-K622 HydrophobicContact CG2-CB 4.17Å; V609-K622 HydrophobicContact CG2-CD 4.23Å; V609-K622 HydrophobicContact CG2-CG 4.26Å
623	A	88.8	Confident	86.9	Confident	2 Å²	2	60.6 Å²	60.6	2%	0.017	33%	0.329	C	S	.	.			trans	-81.9	166.4	171.5	0	0	0	0	0	111.5	L551 R608 F610 T625 L628 K629	L551-A623 HydrophobicContact CD2-CB 4.06Å; R608-A623 WeakPolarHBondContact CB-O 3.41Å; R608-A623 PolarHBondContact O-N 3.34Å; F610-A623 HydrophobicContact CE1-CB 4.46Å; A623-T625 WeakPolarHBondContact CB-O 3.38Å; A623-L628 HydrophobicContact CB-CB 4.19Å; A623-L628 HydrophobicContact CB-CD2 4.29Å; A623-L628 HydrophobicContact CB-CG 4.08Å; A623-K629 HydrophobicContact CB-CB 3.81Å
624	E	85.9	Confident	87.1	Confident	95 Å²	95	62.6 Å²	62.6	44%	0.444	34%	0.336	S	S	.	.	S	Bend	trans	-77.9	-35.2	177.1	-60.7	-178.1	171	0	0	111.3	R564 R608 L628	R564-E624 IonicContact CZ-OE1 3.32Å; R564-E624 IonicContact NE-OE1 2.94Å; R564-E624 PolarHBondContact NE-OE1 2.66Å; R564-E624 IonicContact NH2-OE1 2.58Å; R564-E624 PolarHBondContact NH2-OE1 2.57Å; R608-E624 VanDerWaalsContact CD-O 3.23Å; R608-E624 WeakPolarHBondContact CD-O 3.48Å; E624-L628 HydrophobicContact CB-CD2 4.15Å; E624-L628 HydrophobicContact CG-CD2 4.5Å
625	T	85.8	Confident	87.2	Confident	63 Å²	63	61 Å²	61	39%	0.387	33%	0.331	S	S	.	.	S	Bend	trans	-132.8	167.2	175.8	82.7	0	0	0	0	111.8	A623 E627 L628 K629	A623-T625 WeakPolarHBondContact CB-O 3.38Å; T625-E627 WeakPolarHBondContact CB-OE2 3.45Å; T625-E627 PolarHBondContact OG1-OE2 3.46Å; T625-L628 WeakPolarHBondContact OG1-CB 3.49Å; T625-L628 PolarHBondContact OG1-N 2.93Å; T625-K629 PolarHBondContact O-N 3.1Å; T625-K629 VanDerWaalsContact O-N 3.17Å
626	E	86.4	Confident	87.7	Confident	112 Å²	112	55.2 Å²	55.2	52%	0.523	29%	0.291	S	S	.	.	H	α-helix	trans	-72.6	-35.8	-179.6	-67.6	-175.6	-148.4	0	0	112.4	P607 R608 L628 K629 G630	P607-E626 HydrophobicContact CB-CG 4.12Å; P607-E626 WeakPolarHBondContact CB-OE1 3.28Å; P607-E626 HydrophobicContact CG-CG 4.2Å; P607-E626 WeakPolarHBondContact CG-OE1 3.5Å; R608-E626 HydrophobicContact CG-CG 3.99Å; E626-L628 VanDerWaalsContact C-N 3.29Å; E626-L628 PolarHBondContact O-N 2.87Å; E626-K629 WeakPolarHBondContact O-CB 3.38Å; E626-K629 PolarHBondContact O-N 3.21Å; E626-G630 PolarHBondContact O-N 3.05Å
627	E	85.9	Confident	88.3	Confident	130 Å²	130	55.8 Å²	55.8	61%	0.607	27%	0.273	S	S	*	.	H	α-helix	trans	-67.5	-33.8	176.2	-43.6	73.6	-161.9	0	0	110.8	T625 G630 R631	T625-E627 WeakPolarHBondContact CB-OE2 3.45Å; T625-E627 PolarHBondContact OG1-OE2 3.46Å; E627-G630 PolarHBondContact O-N 2.85Å; E627-R631 WeakPolarHBondContact O-CG 3.02Å; E627-R631 PolarHBondContact O-N 2.84Å; E627-R631 VanDerWaalsContact O-N 3.1Å
628	L	86.1	Confident	88.6	Confident	15 Å²	15	55 Å²	55	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-68.1	-40.5	172.9	-179.1	60.4	0	0	0	111.5	M547 A623 E624 T625 E626 W632	M547-L628 HydrophobicContact CE-CD1 3.65Å; A623-L628 HydrophobicContact CB-CB 4.19Å; A623-L628 HydrophobicContact CB-CD2 4.29Å; A623-L628 HydrophobicContact CB-CG 4.08Å; E624-L628 HydrophobicContact CB-CD2 4.15Å; E624-L628 HydrophobicContact CG-CD2 4.5Å; T625-L628 WeakPolarHBondContact OG1-CB 3.49Å; T625-L628 PolarHBondContact OG1-N 2.93Å; E626-L628 VanDerWaalsContact C-N 3.29Å; E626-L628 PolarHBondContact O-N 2.87Å; L628-W632 VanDerWaalsContact O-CD1 3.32Å; L628-W632 PolarHBondContact O-N 3.44Å; L628-W632 VanDerWaalsContact O-N 3.07Å
629	K	91.6	Very high	88.7	Confident	22 Å²	22	50.8 Å²	50.8	10%	0.096	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-48.7	169.9	159.7	179.9	164.2	179.3	0	111.3	P607 V609 F610 A623 T625 E626 R631 W632 M633	P607-K629 WeakPolarHBondContact O-CD 3.12Å; P607-K629 WeakPolarHBondContact O-CE 3.42Å; P607-K629 PolarHBondContact O-NZ 2.56Å; V609-K629 WeakPolarHBondContact O-CE 3.49Å; V609-K629 PolarHBondContact O-NZ 3.33Å; F610-K629 HydrophobicContact CB-CD 4.33Å; F610-K629 HydrophobicContact CB-CG 4.33Å; F610-K629 HydrophobicContact CD1-CB 4.2Å; F610-K629 HydrophobicContact CD1-CD 4.3Å; F610-K629 HydrophobicContact CD1-CG 3.83Å; F610-K629 HydrophobicContact CG-CG 4.37Å; A623-K629 HydrophobicContact CB-CB 3.81Å; T625-K629 PolarHBondContact O-N 3.1Å; T625-K629 VanDerWaalsContact O-N 3.17Å; E626-K629 WeakPolarHBondContact O-CB 3.38Å; E626-K629 PolarHBondContact O-N 3.21Å; K629-R631 VanDerWaalsContact C-N 3.3Å; K629-R631 PolarHBondContact O-N 3.45Å; K629-W632 PolarHBondContact O-N 3.15Å; K629-M633 HydrophobicContact CD-SD 4.24Å; K629-M633 WeakPolarHBondContact CE-SD 3.39Å; K629-M633 HydrophobicContact CG-CG 4.18Å; K629-M633 HydrophobicContact CG-SD 3.86Å; K629-M633 PolarHBondContact O-N 3.08Å
630	G	87.8	Confident	88.7	Confident	41 Å²	41	49.5 Å²	49.5	42%	0.423	25%	0.245	S	C	.	.	H	α-helix	trans	-58.3	-41.5	-177.9	0	0	0	0	0	112.6	E626 E627 K634	E626-G630 PolarHBondContact O-N 3.05Å; E627-G630 PolarHBondContact O-N 2.85Å; G630-K634 PolarHBondContact O-N 3.08Å
631	R	90.3	Very high	88.6	Confident	143 Å²	143	53.2 Å²	53.2	54%	0.54	27%	0.272	S	S	.	.	H	α-helix	trans	-65.1	-41.7	172.8	-71.7	-173.7	-67.3	135.5	-10	112.9	M547 E627 K629 A635	M547-R631 HydrophobicContact CE-CB 3.76Å; M547-R631 HydrophobicContact SD-CB 4.35Å; E627-R631 WeakPolarHBondContact O-CG 3.02Å; E627-R631 PolarHBondContact O-N 2.84Å; E627-R631 VanDerWaalsContact O-N 3.1Å; K629-R631 VanDerWaalsContact C-N 3.3Å; K629-R631 PolarHBondContact O-N 3.45Å; R631-A635 WeakPolarHBondContact O-CB 3.35Å; R631-A635 PolarHBondContact O-N 2.72Å
632	W	92.6	Very high	88	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-45	177.5	-92	116.7	0	0	0	113.4	M547 S549 L551 C567 I569 L577 F610 L628 K629 A635 M636	M547-W632 HydrophobicContact CB-CE3 4.14Å; M547-W632 HydrophobicContact CB-CH2 4.16Å; M547-W632 HydrophobicContact CB-CZ3 3.87Å; M547-W632 HydrophobicContact CE-CD2 3.88Å; M547-W632 HydrophobicContact CE-CG 3.75Å; M547-W632 HydrophobicContact CG-CD2 3.56Å; M547-W632 HydrophobicContact CG-CE3 3.46Å; M547-W632 VanDerWaalsContact CG-CE3 3.46Å; M547-W632 HydrophobicContact CG-CG 4.31Å; M547-W632 HydrophobicContact CG-CH2 3.75Å; M547-W632 HydrophobicContact CG-CZ2 3.83Å; M547-W632 HydrophobicContact CG-CZ3 3.56Å; S549-W632 PolarHBondContact OG-NE1 3.37Å; L551-W632 HydrophobicContact CD1-CD2 3.95Å; L551-W632 HydrophobicContact CD1-CG 4.17Å; L551-W632 HydrophobicContact CD1-CZ2 4.12Å; L551-W632 HydrophobicContact CD2-CG 4.32Å; L551-W632 HydrophobicContact CG-CZ2 4.43Å; C567-W632 HydrophobicContact CB-CH2 3.72Å; C567-W632 HydrophobicContact CB-CZ2 3.69Å; C567-W632 WeakPolarHBondContact O-CH2 3.09Å; C567-W632 WeakPolarHBondContact O-CZ2 3.28Å; I569-W632 HydrophobicContact CD1-CE3 4.45Å; I569-W632 HydrophobicContact CD1-CZ3 3.86Å; I569-W632 HydrophobicContact CG1-CZ3 4.04Å; L577-W632 HydrophobicContact CD1-CH2 4.15Å; L577-W632 HydrophobicContact CD1-CZ3 3.99Å; F610-W632 HydrophobicContact CE1-CB 4.19Å; F610-W632 HydrophobicContact CE2-CB 4.27Å; F610-W632 HydrophobicContact CZ-CB 3.69Å; F610-W632 HydrophobicContact CZ-CG 4.17Å; L628-W632 VanDerWaalsContact O-CD1 3.32Å; L628-W632 PolarHBondContact O-N 3.44Å; L628-W632 VanDerWaalsContact O-N 3.07Å; K629-W632 PolarHBondContact O-N 3.15Å; W632-A635 PolarHBondContact O-N 3.11Å; W632-M636 HydrophobicContact CD2-CE 4.06Å; W632-M636 HydrophobicContact CE3-CE 3.34Å; W632-M636 HydrophobicContact CE3-CG 4.28Å; W632-M636 HydrophobicContact CZ3-CE 3.7Å; W632-M636 WeakPolarHBondContact O-CB 3.23Å; W632-M636 WeakPolarHBondContact O-CG 3.3Å; W632-M636 PolarHBondContact O-N 3.24Å
633	M	91.7	Very high	87.4	Confident	22 Å²	22	58 Å²	58	11%	0.108	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-51.8	177.7	-71.8	-177	68	0	0	110.3	V599 V601 F610 K629 A635 M636 E637	V599-M633 HydrophobicContact CG1-CB 4.04Å; V599-M633 HydrophobicContact CG1-CE 4.1Å; V599-M633 HydrophobicContact CG1-CG 3.95Å; V601-M633 HydrophobicContact CG2-CE 4.01Å; F610-M633 HydrophobicContact CB-CG 3.82Å; F610-M633 HydrophobicContact CB-SD 3.72Å; F610-M633 HydrophobicContact CD2-CG 3.98Å; F610-M633 HydrophobicContact CG-CG 3.9Å; F610-M633 HydrophobicContact CG-SD 4.42Å; K629-M633 HydrophobicContact CD-SD 4.24Å; K629-M633 WeakPolarHBondContact CE-SD 3.39Å; K629-M633 HydrophobicContact CG-CG 4.18Å; K629-M633 HydrophobicContact CG-SD 3.86Å; K629-M633 PolarHBondContact O-N 3.08Å; M633-A635 PolarHBondContact O-N 2.94Å; M633-M636 PolarHBondContact O-N 3.17Å; M633-M636 VanDerWaalsContact O-N 3.15Å; M633-E637 WeakPolarHBondContact O-CB 3.26Å; M633-E637 VanDerWaalsContact O-CG 3.23Å; M633-E637 WeakPolarHBondContact O-CG 3.13Å; M633-E637 PolarHBondContact O-N 3.42Å
634	K	90.5	Very high	86.1	Confident	132 Å²	132	61.3 Å²	61.3	57%	0.574	32%	0.322	S	S	*	.	H	α-helix	trans	-55.8	-46.1	176.7	-174.9	178.9	178.7	179.1	0	112.8	G630 M636 E637 Q638	G630-K634 PolarHBondContact O-N 3.08Å; K634-M636 VanDerWaalsContact C-N 3.35Å; K634-M636 PolarHBondContact O-N 2.91Å; K634-E637 PolarHBondContact O-N 3.1Å; K634-Q638 VanDerWaalsContact O-CG 3.3Å; K634-Q638 WeakPolarHBondContact O-CG 3.23Å; K634-Q638 PolarHBondContact O-N 3.46Å
635	A	88.6	Confident	84.8	Confident	17 Å²	17	58.6 Å²	58.6	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-39	179.4	0	0	0	0	0	112.4	M547 I569 R631 W632 M633 A639	M547-A635 HydrophobicContact CB-CB 3.8Å; M547-A635 HydrophobicContact CG-CB 4.17Å; I569-A635 HydrophobicContact CD1-CB 4.39Å; R631-A635 WeakPolarHBondContact O-CB 3.35Å; R631-A635 PolarHBondContact O-N 2.72Å; W632-A635 PolarHBondContact O-N 3.11Å; M633-A635 PolarHBondContact O-N 2.94Å; A635-A639 PolarHBondContact O-N 3.02Å; A635-A639 VanDerWaalsContact O-N 3.1Å
636	M	91.3	Very high	83	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-72.8	-34.2	176.6	-67.8	-178	-173	0	0	112.5	L551 I569 L577 L594 V599 F610 L612 W632 M633 K634 A639 A640	L551-M636 HydrophobicContact CD1-CE 4.22Å; I569-M636 HydrophobicContact CD1-CG 4.05Å; L577-M636 HydrophobicContact CD1-CE 4.12Å; L577-M636 HydrophobicContact CD2-CE 3.62Å; L577-M636 HydrophobicContact CD2-SD 4.45Å; L594-M636 HydrophobicContact CD1-CG 4.26Å; V599-M636 HydrophobicContact CG2-CB 3.97Å; F610-M636 HydrophobicContact CE2-CE 3.98Å; F610-M636 HydrophobicContact CE2-SD 3.77Å; F610-M636 HydrophobicContact CZ-CE 4.29Å; L612-M636 HydrophobicContact CD1-SD 3.75Å; L612-M636 HydrophobicContact CD2-CB 4.19Å; L612-M636 HydrophobicContact CD2-SD 3.77Å; L612-M636 HydrophobicContact CG-SD 3.93Å; W632-M636 HydrophobicContact CD2-CE 4.06Å; W632-M636 HydrophobicContact CE3-CE 3.34Å; W632-M636 HydrophobicContact CE3-CG 4.28Å; W632-M636 HydrophobicContact CZ3-CE 3.7Å; W632-M636 WeakPolarHBondContact O-CB 3.23Å; W632-M636 WeakPolarHBondContact O-CG 3.3Å; W632-M636 PolarHBondContact O-N 3.24Å; M633-M636 PolarHBondContact O-N 3.17Å; M633-M636 VanDerWaalsContact O-N 3.15Å; K634-M636 VanDerWaalsContact C-N 3.35Å; K634-M636 PolarHBondContact O-N 2.91Å; M636-A639 PolarHBondContact O-N 3.44Å; M636-A640 WeakPolarHBondContact O-CB 3.44Å; M636-A640 PolarHBondContact O-N 2.89Å
637	E	90.2	Very high	80.7	Confident	88 Å²	88	66.6 Å²	66.6	41%	0.411	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-41.2	173.6	-72.2	158.9	-162.6	0	0	111.6	V599 M633 K634 A640 S641	V599-E637 HydrophobicContact CB-CG 3.7Å; V599-E637 HydrophobicContact CG1-CG 4.3Å; V599-E637 HydrophobicContact CG2-CB 4.43Å; V599-E637 HydrophobicContact CG2-CG 3.62Å; M633-E637 WeakPolarHBondContact O-CB 3.26Å; M633-E637 VanDerWaalsContact O-CG 3.23Å; M633-E637 WeakPolarHBondContact O-CG 3.13Å; M633-E637 PolarHBondContact O-N 3.42Å; K634-E637 PolarHBondContact O-N 3.1Å; E637-A640 PolarHBondContact O-N 3.14Å; E637-S641 WeakPolarHBondContact O-CB 3.36Å; E637-S641 PolarHBondContact O-N 3.48Å; E637-S641 PolarHBondContact O-OG 3.47Å
638	Q	87.5	Confident	78.4	Confident	75 Å²	75	66.1 Å²	66.1	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-47.6	174.8	-70.5	178.7	-77	0	0	111.2	K634 A640 S641 W643	K634-Q638 VanDerWaalsContact O-CG 3.3Å; K634-Q638 WeakPolarHBondContact O-CG 3.23Å; K634-Q638 PolarHBondContact O-N 3.46Å; Q638-A640 PolarHBondContact O-N 3Å; Q638-S641 PolarHBondContact O-N 3.45Å; Q638-S641 PolarHBondContact O-OG 3.1Å; Q638-W643 HydrophobicContact CB-CE3 4.38Å; Q638-W643 WeakPolarHBondContact O-CB 3.48Å; Q638-W643 PolarHBondContact O-N 2.83Å
639	A	87.2	Confident	75.8	Confident	3 Å²	3	72.2 Å²	72.2	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-63.4	-40.3	175.5	0	0	0	0	0	112.7	P574 L575 L594 A635 M636 S641 G642	P574-A639 WeakPolarHBondContact O-CB 3.46Å; L575-A639 WeakPolarHBondContact CD2-O 3.45Å; L594-A639 HydrophobicContact CB-CB 3.97Å; L594-A639 HydrophobicContact CD1-CB 3.47Å; L594-A639 VanDerWaalsContact CD1-CB 3.47Å; L594-A639 HydrophobicContact CG-CB 4.38Å; A635-A639 PolarHBondContact O-N 3.02Å; A635-A639 VanDerWaalsContact O-N 3.1Å; M636-A639 PolarHBondContact O-N 3.44Å; A639-S641 VanDerWaalsContact C-N 3.34Å; A639-S641 PolarHBondContact O-N 2.81Å; A639-G642 PolarHBondContact O-N 2.93Å; A639-G642 VanDerWaalsContact O-N 3.1Å
640	A	87.4	Confident	73.3	Confident	12 Å²	12	79.4 Å²	79.4	10%	0.099	43%	0.429	C	S	.	.	H	α-helix	trans	-69.9	-28.9	-178.9	0	0	0	0	0	113.8	L594 G596 Y597 M636 E637 Q638 G642	L594-A640 VanDerWaalsContact O-CA 3.23Å; L594-A640 WeakPolarHBondContact O-CA 3.45Å; L594-A640 WeakPolarHBondContact O-CB 3.38Å; G596-A640 PolarHBondContact N-O 2.79Å; Y597-A640 VanDerWaalsContact O-CB 3.26Å; Y597-A640 WeakPolarHBondContact O-CB 3.42Å; M636-A640 WeakPolarHBondContact O-CB 3.44Å; M636-A640 PolarHBondContact O-N 2.89Å; E637-A640 PolarHBondContact O-N 3.14Å; Q638-A640 PolarHBondContact O-N 3Å; A640-G642 PolarHBondContact O-N 3.01Å
641	S	85.3	Confident	70.9	Confident	97 Å²	97	79.9 Å²	79.9	68%	0.678	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	1.5	171.6	49.4	0	0	0	0	113.8	E637 Q638 A639	E637-S641 WeakPolarHBondContact O-CB 3.36Å; E637-S641 PolarHBondContact O-N 3.48Å; E637-S641 PolarHBondContact O-OG 3.47Å; Q638-S641 PolarHBondContact O-N 3.45Å; Q638-S641 PolarHBondContact O-OG 3.1Å; A639-S641 VanDerWaalsContact C-N 3.34Å; A639-S641 PolarHBondContact O-N 2.81Å
642	G	77.8	Confident	68.1	Low	33 Å²	33	80.4 Å²	80.4	34%	0.34	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	13.4	175.6	0	0	0	0	0	114.7	A639 A640	A639-G642 PolarHBondContact O-N 2.93Å; A639-G642 VanDerWaalsContact O-N 3.1Å; A640-G642 PolarHBondContact O-N 3.01Å
643	W	76.6	Confident	65.7	Low	117 Å²	117	89 Å²	89	44%	0.443	49%	0.492	S	S	.	.			trans	-69.2	136.1	177.3	179	83.6	0	0	0	111.5	L546 Q638 P645	L546-W643 HydrophobicContact CD1-CZ3 3.96Å; L546-W643 HydrophobicContact CD2-CH2 4.29Å; L546-W643 HydrophobicContact CD2-CZ3 3.94Å; Q638-W643 HydrophobicContact CB-CE3 4.38Å; Q638-W643 WeakPolarHBondContact O-CB 3.48Å; Q638-W643 PolarHBondContact O-N 2.83Å; W643-P645 HydrophobicContact CH2-CB 3.87Å; W643-P645 HydrophobicContact CZ2-CB 4.34Å; W643-P645 HydrophobicContact CZ3-CB 4.42Å
644	S	62.1	Low	63.1	Low	70 Å²	70	92.4 Å²	92.4	49%	0.49	52%	0.518	S	S	.	.			trans	-125.8	146	171.3	58.6	0	0	0	0	110.7	S646	S644-S646 PolarHBondContact O-N 3.36Å
645	P	58.9	Low	60.4	Low	38 Å²	38	97.6 Å²	97.6	25%	0.247	55%	0.552	C	S	.	*			trans	-72.7	110.8	170.7	29.7	-32.1	0	0	0	109.3	L546 W643	L546-P645 HydrophobicContact CD2-CG 4.32Å; W643-P645 HydrophobicContact CH2-CB 3.87Å; W643-P645 HydrophobicContact CZ2-CB 4.34Å; W643-P645 HydrophobicContact CZ3-CB 4.42Å
646	S	48	Very low	59	Low	111 Å²	111	101.6 Å²	101.6	78%	0.776	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-63.6	134.4	172	52	0	0	0	0	111	S644	S644-S646 PolarHBondContact O-N 3.36Å
647	W	36.7	Very low	57.3	Low	232 Å²	232	106.9 Å²	106.9	88%	0.879	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-60.1	152.6	161.5	-70.2	83.6	0	0	0	109.8	N649	W647-N649 PolarHBondContact O-N 2.87Å
648	P	37.4	Very low	55.5	Low	121 Å²	121	108 Å²	108	79%	0.786	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-59.2	132.1	174.8	26.5	-34.5	0	0	0	109.7
649	N	32.5	Very low	53.6	Low	143 Å²	143	109.9 Å²	109.9	77%	0.765	63%	0.628	S	S	*	*			trans	-90	111.8	-177.2	-167.2	67.9	0	0	0	109.2	W647 G651	W647-N649 PolarHBondContact O-N 2.87Å; N649-G651 VanDerWaalsContact C-N 3.34Å; N649-G651 PolarHBondContact O-N 3.2Å
650	D	39.3	Very low	51.5	Low	173 Å²	173	116.6 Å²	116.6	93%	0.925	67%	0.666	S	S	*	*	S	Bend	trans	-64.5	96.4	164.3	-86.2	-40.7	0	0	0	108.1
651	G	37.5	Very low	49.1	Very low	51 Å²	51	123.6 Å²	123.6	53%	0.526	70%	0.704	S	S	.	*			trans	168.6	60.5	-171.7	0	0	0	0	0	114.8	N649	N649-G651 VanDerWaalsContact C-N 3.34Å; N649-G651 PolarHBondContact O-N 3.2Å
652	D	31.7	Very low	46.5	Very low	154 Å²	154	125.5 Å²	125.5	82%	0.824	71%	0.706	S	S	*	*			trans	-137.5	86.4	151.8	-115.5	-23.1	0	0	0	108.6
653	L	42.1	Very low	44.1	Very low	181 Å²	181	132.6 Å²	132.6	95%	0.948	73%	0.734	S	S	*	*			trans	-135.1	62.8	174.2	-86.8	178.7	0	0	0	109.2
654	S	37	Very low	41.4	Very low	92 Å²	92	133.9 Å²	133.9	64%	0.643	76%	0.758	S	S	*	*			trans	-159.4	119.7	166.5	53.2	0	0	0	0	111.3
655	D	34.1	Very low	39.6	Very low	241 Å²	241	139.7 Å²	139.7	100%	1.289	78%	0.782	S	S	*	*			trans	55.4	0	163.1	-54.1	-13.4	0	0	0	119.4

Retrieved 655 of 655 residues in 180.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).